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

Systemtic Name: 2-[(4Z)-4-[(2-nitrophenyl)methylidene]-5-oxidanylidene-2-phenyl-imidazol-1-yl]-4-sulfo-benzoic acid Openeye Name: 2-[(4Z)-4-[(2-nitrophenyl)methylene]-5-oxo-2-phenyl-imidazol-1-yl]-4-sulfo-benzoic acid CAS Name: 2-[(4Z)-4-[(2-nitrophenyl)methylidene]-5-oxo-2-phenyl-1-imidazolyl]-4-sulfobenzoic acid IUPAC Name: 2-[(4Z)-4-[(2-nitrophenyl)methylidene]-5-oxo-2-phenylimidazol-1-yl]-4-sulfobenzoic acid Traditional Name: 2-[(4Z)-5-keto-4-(2-nitrobenzylidene)-2-phenyl-2-imidazolin-1-yl]-4-sulfo-benzoic acid Formula: C23H15N3O8S MolecularWeight: 493.4455

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC(=CC3=CC=CC=C3[N+](=O)[O-])C(=O)N2C4=C(C=CC(=C4)S(=O)(=O)O)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C2=N/C(=C\C3=CC=CC=C3[N+](=O)[O-])/C(=O)N2C4=C(C=CC(=C4)S(=O)(=O)O)C(=O)O

InChI

InChI=1S/C23H15N3O8S/c27-22-18(12-15-8-4-5-9-19(15)26(30)31)24-21(14-6-2-1-3-7-14)25(22)20-13-16(35(32,33)34)10-11-17(20)23(28)29/h1-13H,(H,28,29)(H,32,33,34)/b18-12-