4-[4-[(5-nitro-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methyl]-3-oxidanylidene-5-phenyl-1H-pyrazol-2-yl]benzoic acid

Systemtic Name: 4-[4-[(5-nitro-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methyl]-3-oxidanylidene-5-phenyl-1H-pyrazol-2-yl]benzoic acid Openeye Name: 4-[4-[(5-nitro-6-oxo-cyclohexa-2,4-dien-1-ylidene)methyl]-3-oxo-5-phenyl-1H-pyrazol-2-yl]benzoic acid CAS Name: 4-[4-[(5-nitro-6-oxo-1-cyclohexa-2,4-dienylidene)methyl]-3-oxo-5-phenyl-1H-pyrazol-2-yl]benzoic acid IUPAC Name: 4-[4-[(5-nitro-6-oxocyclohexa-2,4-dien-1-ylidene)methyl]-3-oxo-5-phenyl-1H-pyrazol-2-yl]benzoic acid Traditional Name: 4-[5-keto-4-[(6-keto-5-nitro-cyclohexa-2,4-dien-1-ylidene)methyl]-3-phenyl-3-pyrazolin-1-yl]benzoic acid Formula: C23H15N3O6 MolecularWeight: 429.3817

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(C(=O)N(N2)C3=CC=C(C=C3)C(=O)O)C=C4C=CC=C(C4=O)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C2=C(C(=O)N(N2)C3=CC=C(C=C3)C(=O)O)C=C4C=CC=C(C4=O)[N+](=O)[O-]

InChI

InChI=1S/C23H15N3O6/c27-21-16(7-4-8-19(21)26(31)32)13-18-20(14-5-2-1-3-6-14)24-25(22(18)28)17-11-9-15(10-12-17)23(29)30/h1-13,24H,(H,29,30)