2-[(4Z)-4-[(2-nitrophenyl)methylidene]-5-oxidanylidene-2-phenyl-imidazol-1-yl]naphthalene-1,5-disulfonic acid

Systemtic Name: 2-[(4Z)-4-[(2-nitrophenyl)methylidene]-5-oxidanylidene-2-phenyl-imidazol-1-yl]naphthalene-1,5-disulfonic acid Openeye Name: 2-[(4Z)-4-[(2-nitrophenyl)methylene]-5-oxo-2-phenyl-imidazol-1-yl]naphthalene-1,5-disulfonic acid CAS Name: 2-[(4Z)-4-[(2-nitrophenyl)methylidene]-5-oxo-2-phenyl-1-imidazolyl]naphthalene-1,5-disulfonic acid IUPAC Name: 2-[(4Z)-4-[(2-nitrophenyl)methylidene]-5-oxo-2-phenylimidazol-1-yl]naphthalene-1,5-disulfonic acid Traditional Name: 2-[(4Z)-5-keto-4-(2-nitrobenzylidene)-2-phenyl-2-imidazolin-1-yl]naphthalene-1,5-disulfonic acid Formula: C26H17N3O9S2 MolecularWeight: 579.55788

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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(C5=C(C=C4)C(=CC=C5)S(=O)(=O)O)S(=O)(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C2=N/C(=C\C3=CC=CC=C3[N+](=O)[O-])/C(=O)N2C4=C(C5=C(C=C4)C(=CC=C5)S(=O)(=O)O)S(=O)(=O)O

InChI

InChI=1S/C26H17N3O9S2/c30-26-20(15-17-9-4-5-11-21(17)29(31)32)27-25(16-7-2-1-3-8-16)28(26)22-14-13-18-19(24(22)40(36,37)38)10-6-12-23(18)39(33,34)35/h1-15H,(H,33,34,35)(H,36,37,38)/b20-15-