3-azanyl-2,4-bis(chloranyl)-6-(2,7-diethyl-3-oxidanyl-6-oxidanylidene-xanthen-9-yl)benzoic acid

Systemtic Name: 3-azanyl-2,4-bis(chloranyl)-6-(2,7-diethyl-3-oxidanyl-6-oxidanylidene-xanthen-9-yl)benzoic acid Openeye Name: 3-amino-2,4-dichloro-6-(2,7-diethyl-3-hydroxy-6-oxo-xanthen-9-yl)benzoic acid CAS Name: 3-amino-2,4-dichloro-6-(2,7-diethyl-3-hydroxy-6-oxo-9-xanthenyl)benzoic acid IUPAC Name: 3-amino-2,4-dichloro-6-(2,7-diethyl-3-hydroxy-6-oxoxanthen-9-yl)benzoic acid Traditional Name: 3-amino-2,4-dichloro-6-(2,7-diethyl-3-hydroxy-6-keto-xanthen-9-yl)benzoic acid Formula: C24H19Cl2NO5 MolecularWeight: 472.31736

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C3=CC(=C(C=C3OC2=CC1=O)O)CC)C4=CC(=C(C(=C4C(=O)O)Cl)N)Cl

Isomeric SMILES

CCC1=CC2=C(C3=CC(=C(C=C3OC2=CC1=O)O)CC)C4=CC(=C(C(=C4C(=O)O)Cl)N)Cl

InChI

InChI=1S/C24H19Cl2NO5/c1-3-10-5-12-18(8-16(10)28)32-19-9-17(29)11(4-2)6-13(19)20(12)14-7-15(25)23(27)22(26)21(14)24(30)31/h5-9,28H,3-4,27H2,1-2H3,(H,30,31)