2-[1-azanyl-4-oxidanyl-9,10-bis(oxidanylidene)anthracen-2-yl]oxy-3-(2-methylbutan-2-yl)benzenesulfonic acid

Systemtic Name: 2-[1-azanyl-4-oxidanyl-9,10-bis(oxidanylidene)anthracen-2-yl]oxy-3-(2-methylbutan-2-yl)benzenesulfonic acid Openeye Name: 2-[(1-amino-4-hydroxy-9,10-dioxo-2-anthryl)oxy]-3-(1,1-dimethylpropyl)benzenesulfonic acid CAS Name: 2-[(1-amino-4-hydroxy-9,10-dioxo-2-anthracenyl)oxy]-3-(2-methylbutan-2-yl)benzenesulfonic acid IUPAC Name: 2-(1-amino-4-hydroxy-9,10-dioxoanthracen-2-yl)oxy-3-(2-methylbutan-2-yl)benzenesulfonic acid Traditional Name: 2-[(1-amino-4-hydroxy-9,10-diketo-2-anthryl)oxy]-3-tert-amyl-besylic acid Formula: C25H23NO7S MolecularWeight: 481.51762

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1=C(C(=CC=C1)S(=O)(=O)O)OC2=C(C3=C(C(=C2)O)C(=O)C4=CC=CC=C4C3=O)N

Isomeric SMILES

CCC(C)(C)C1=C(C(=CC=C1)S(=O)(=O)O)OC2=C(C3=C(C(=C2)O)C(=O)C4=CC=CC=C4C3=O)N

InChI

InChI=1S/C25H23NO7S/c1-4-25(2,3)15-10-7-11-18(34(30,31)32)24(15)33-17-12-16(27)19-20(21(17)26)23(29)14-9-6-5-8-13(14)22(19)28/h5-12,27H,4,26H2,1-3H3,(H,30,31,32)