2-[(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)amino]-4-(4-methylphenyl)-4-oxidanylidene-but-2-enoic acid

Systemtic Name: 2-[(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)amino]-4-(4-methylphenyl)-4-oxidanylidene-but-2-enoic acid Openeye Name: 2-[(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)amino]-4-oxo-4-(p-tolyl)but-2-enoic acid CAS Name: 2-[(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)amino]-4-(4-methylphenyl)-4-oxo-2-butenoic acid IUPAC Name: 2-[(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)amino]-4-(4-methylphenyl)-4-oxobut-2-enoic acid Traditional Name: 4-keto-2-[(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)amino]-4-(p-tolyl)but-2-enoic acid Formula: C22H21N3O4 MolecularWeight: 391.41984

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)C=C(C(=O)O)NC2=C(N(N(C2=O)C3=CC=CC=C3)C)C

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)C=C(C(=O)O)NC2=C(N(N(C2=O)C3=CC=CC=C3)C)C

InChI

InChI=1S/C22H21N3O4/c1-14-9-11-16(12-10-14)19(26)13-18(22(28)29)23-20-15(2)24(3)25(21(20)27)17-7-5-4-6-8-17/h4-13,23H,1-3H3,(H,28,29)