2-[[(Z)-[7-[(8Z)-8-[[(2-carboxyphenyl)amino]methylidene]-4-[(2-carboxyphenyl)diazenyl]-3-methyl-6-oxidanyl-1,7-bis(oxidanylidene)-5-propan-2-yl-4H-naphthalen-2-yl]-5-[(2-carboxyphenyl)diazenyl]-6-methyl-3-oxidanyl-2,8-bis(oxidanylidene)-4-propan-2-yl-5H-naphthalen-1-ylidene]methyl]amino]benzoic acid

Systemtic Name: 2-[[(Z)-[7-[(8Z)-8-[[(2-carboxyphenyl)amino]methylidene]-4-[(2-carboxyphenyl)diazenyl]-3-methyl-6-oxidanyl-1,7-bis(oxidanylidene)-5-propan-2-yl-4H-naphthalen-2-yl]-5-[(2-carboxyphenyl)diazenyl]-6-methyl-3-oxidanyl-2,8-bis(oxidanylidene)-4-propan-2-yl-5H-naphthalen-1-ylidene]methyl]amino]benzoic acid Openeye Name: 2-[[(Z)-[7-[(8Z)-8-[(2-carboxyanilino)methylene]-4-(2-carboxyphenyl)azo-6-hydroxy-5-isopropyl-3-methyl-1,7-dioxo-4H-naphthalen-2-yl]-5-(2-carboxyphenyl)azo-3-hydroxy-4-isopropyl-6-methyl-2,8-dioxo-5H-naphthalen-1-ylidene]methyl]amino]benzoic acid CAS Name: 2-[[(Z)-[7-[(8Z)-8-[(2-carboxyanilino)methylidene]-4-(2-carboxyphenyl)azo-6-hydroxy-3-methyl-1,7-dioxo-5-propan-2-yl-4H-naphthalen-2-yl]-5-(2-carboxyphenyl)azo-3-hydroxy-6-methyl-2,8-dioxo-4-propan-2-yl-5H-naphthalen-1-ylidene]methyl]amino]benzoic acid IUPAC Name: 2-[[(Z)-[7-[(8Z)-8-[(2-carboxyanilino)methylidene]-4-[(2-carboxyphenyl)diazenyl]-6-hydroxy-3-methyl-1,7-dioxo-5-propan-2-yl-4H-naphthalen-2-yl]-5-[(2-carboxyphenyl)diazenyl]-3-hydroxy-6-methyl-2,8-dioxo-4-propan-2-yl-5H-naphthalen-1-ylidene]methyl]amino]benzoic acid Traditional Name: 2-[[(Z)-[7-[(8Z)-8-[(2-carboxyanilino)methylene]-4-(2-carboxyphenyl)azo-6-hydroxy-5-isopropyl-1,7-diketo-3-methyl-4H-naphthalen-2-yl]-5-(2-carboxyphenyl)azo-3-hydroxy-4-isopropyl-2,8-diketo-6-methyl-5H-naphthalen-1-ylidene]methyl]amino]benzoic acid Formula: C58H48N6O14 MolecularWeight: 1053.03352

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)C2=C(C1N=NC3=CC=CC=C3C(=O)O)C(=C(C(=O)C2=CNC4=CC=CC=C4C(=O)O)O)C(C)C)C5=C(C(C6=C(C5=O)C(=CNC7=CC=CC=C7C(=O)O)C(=O)C(=C6C(C)C)O)N=NC8=CC=CC=C8C(=O)O)C

Isomeric SMILES

CC1=C(C(=O)C\2=C(C1N=NC3=CC=CC=C3C(=O)O)C(=C(C(=O)/C2=C\NC4=CC=CC=C4C(=O)O)O)C(C)C)C5=C(C(C6=C(C5=O)/C(=C/NC7=CC=CC=C7C(=O)O)/C(=O)C(=C6C(C)C)O)N=NC8=CC=CC=C8C(=O)O)C

InChI

InChI=1S/C58H48N6O14/c1-25(2)39-45-43(33(49(65)53(39)69)23-59-35-19-11-7-15-29(35)55(71)72)51(67)41(27(5)47(45)63-61-37-21-13-9-17-31(37)57(75)76)42-28(6)48(64-62-38-22-14-10-18-32(38)58(77)78)46-40(26(3)4)54(70)50(66)34(44(46)52(42)68)24-60-36-20-12-8-16-30(36)56(73)74/h7-26,47-48,59-60,69-70H,1-6H3,(H,71,72)(H,73,74)(H,75,76)(H,77,78)/b33-23-,34-24-,63-61?,64-62?