2-[(4Z)-4-[(3-methoxy-4-oxidanyl-phenyl)methylidene]-5-oxidanylidene-2-phenyl-imidazol-1-yl]-4-sulfo-benzoic acid

Systemtic Name: 2-[(4Z)-4-[(3-methoxy-4-oxidanyl-phenyl)methylidene]-5-oxidanylidene-2-phenyl-imidazol-1-yl]-4-sulfo-benzoic acid Openeye Name: 2-[(4Z)-4-[(4-hydroxy-3-methoxy-phenyl)methylene]-5-oxo-2-phenyl-imidazol-1-yl]-4-sulfo-benzoic acid CAS Name: 2-[(4Z)-4-[(4-hydroxy-3-methoxyphenyl)methylidene]-5-oxo-2-phenyl-1-imidazolyl]-4-sulfobenzoic acid IUPAC Name: 2-[(4Z)-4-[(4-hydroxy-3-methoxyphenyl)methylidene]-5-oxo-2-phenylimidazol-1-yl]-4-sulfobenzoic acid Traditional Name: 2-[(4Z)-5-keto-2-phenyl-4-vanillylidene-2-imidazolin-1-yl]-4-sulfo-benzoic acid Formula: C24H18N2O8S MolecularWeight: 494.47332

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=C2C(=O)N(C(=N2)C3=CC=CC=C3)C4=C(C=CC(=C4)S(=O)(=O)O)C(=O)O)O

Isomeric SMILES

COC1=C(C=CC(=C1)/C=C\2/C(=O)N(C(=N2)C3=CC=CC=C3)C4=C(C=CC(=C4)S(=O)(=O)O)C(=O)O)O

InChI

InChI=1S/C24H18N2O8S/c1-34-21-12-14(7-10-20(21)27)11-18-23(28)26(22(25-18)15-5-3-2-4-6-15)19-13-16(35(31,32)33)8-9-17(19)24(29)30/h2-13,27H,1H3,(H,29,30)(H,31,32,33)/b18-11-