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

Systemtic Name: 3-[3-oxidanylidene-4-[(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)methyl]-5-phenyl-1H-pyrazol-2-yl]benzoic acid Openeye Name: 3-[3-oxo-4-[(6-oxocyclohexa-2,4-dien-1-ylidene)methyl]-5-phenyl-1H-pyrazol-2-yl]benzoic acid CAS Name: 3-[3-oxo-4-[(6-oxo-1-cyclohexa-2,4-dienylidene)methyl]-5-phenyl-1H-pyrazol-2-yl]benzoic acid IUPAC Name: 3-[3-oxo-4-[(6-oxocyclohexa-2,4-dien-1-ylidene)methyl]-5-phenyl-1H-pyrazol-2-yl]benzoic acid Traditional Name: 3-[5-keto-4-[(6-ketocyclohexa-2,4-dien-1-ylidene)methyl]-3-phenyl-3-pyrazolin-1-yl]benzoic acid Formula: C23H16N2O4 MolecularWeight: 384.38414

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(C(=O)N(N2)C3=CC=CC(=C3)C(=O)O)C=C4C=CC=CC4=O

Isomeric SMILES

C1=CC=C(C=C1)C2=C(C(=O)N(N2)C3=CC=CC(=C3)C(=O)O)C=C4C=CC=CC4=O

InChI

InChI=1S/C23H16N2O4/c26-20-12-5-4-9-16(20)14-19-21(15-7-2-1-3-8-15)24-25(22(19)27)18-11-6-10-17(13-18)23(28)29/h1-14,24H,(H,28,29)