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

Systemtic Name: 2-[(4Z)-5-oxidanylidene-2-phenyl-4-[(3,4,5-trimethoxyphenyl)methylidene]imidazol-1-yl]-4-sulfo-benzoic acid Openeye Name: 2-[(4Z)-5-oxo-2-phenyl-4-[(3,4,5-trimethoxyphenyl)methylene]imidazol-1-yl]-4-sulfo-benzoic acid CAS Name: 2-[(4Z)-5-oxo-2-phenyl-4-[(3,4,5-trimethoxyphenyl)methylidene]-1-imidazolyl]-4-sulfobenzoic acid IUPAC Name: 2-[(4Z)-5-oxo-2-phenyl-4-[(3,4,5-trimethoxyphenyl)methylidene]imidazol-1-yl]-4-sulfobenzoic acid Traditional Name: 2-[(4Z)-5-keto-2-phenyl-4-(3,4,5-trimethoxybenzylidene)-2-imidazolin-1-yl]-4-sulfo-benzoic acid Formula: C26H22N2O9S MolecularWeight: 538.52588

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C=C2C(=O)N(C(=N2)C3=CC=CC=C3)C4=C(C=CC(=C4)S(=O)(=O)O)C(=O)O

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)/C=C\2/C(=O)N(C(=N2)C3=CC=CC=C3)C4=C(C=CC(=C4)S(=O)(=O)O)C(=O)O

InChI

InChI=1S/C26H22N2O9S/c1-35-21-12-15(13-22(36-2)23(21)37-3)11-19-25(29)28(24(27-19)16-7-5-4-6-8-16)20-14-17(38(32,33)34)9-10-18(20)26(30)31/h4-14H,1-3H3,(H,30,31)(H,32,33,34)/b19-11-