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

Systemtic Name: 4-[5-methyl-4-[(3-methyl-5-oxidanylidene-1-phenyl-pyrazol-4-ylidene)methyl]-3-oxidanylidene-1H-pyrazol-2-yl]benzoic acid Openeye Name: 4-[5-methyl-4-[(3-methyl-5-oxo-1-phenyl-pyrazol-4-ylidene)methyl]-3-oxo-1H-pyrazol-2-yl]benzoic acid CAS Name: 4-[5-methyl-4-[(3-methyl-5-oxo-1-phenyl-4-pyrazolylidene)methyl]-3-oxo-1H-pyrazol-2-yl]benzoic acid IUPAC Name: 4-[5-methyl-4-[(3-methyl-5-oxo-1-phenylpyrazol-4-ylidene)methyl]-3-oxo-1H-pyrazol-2-yl]benzoic acid Traditional Name: 4-[5-keto-4-[(5-keto-3-methyl-1-phenyl-2-pyrazolin-4-ylidene)methyl]-3-methyl-3-pyrazolin-1-yl]benzoic acid Formula: C22H18N4O4 MolecularWeight: 402.40272

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1)C2=CC=C(C=C2)C(=O)O)C=C3C(=NN(C3=O)C4=CC=CC=C4)C

Isomeric SMILES

CC1=C(C(=O)N(N1)C2=CC=C(C=C2)C(=O)O)C=C3C(=NN(C3=O)C4=CC=CC=C4)C

InChI

InChI=1S/C22H18N4O4/c1-13-18(20(27)25(23-13)16-6-4-3-5-7-16)12-19-14(2)24-26(21(19)28)17-10-8-15(9-11-17)22(29)30/h3-12,24H,1-2H3,(H,29,30)