4-[(4E)-4-[[3,5-dimethyl-1-(4-methylphenyl)pyrazol-4-yl]methylidene]-3-methyl-5-oxidanylidene-pyrazol-1-yl]benzoate

Systemtic Name: 4-[(4E)-4-[[3,5-dimethyl-1-(4-methylphenyl)pyrazol-4-yl]methylidene]-3-methyl-5-oxidanylidene-pyrazol-1-yl]benzoate Openeye Name: 4-[(4E)-4-[[3,5-dimethyl-1-(p-tolyl)pyrazol-4-yl]methylene]-3-methyl-5-oxo-pyrazol-1-yl]benzoate CAS Name: 4-[(4E)-4-[[3,5-dimethyl-1-(4-methylphenyl)-4-pyrazolyl]methylidene]-3-methyl-5-oxo-1-pyrazolyl]benzoate IUPAC Name: 4-[(4E)-4-[[3,5-dimethyl-1-(4-methylphenyl)pyrazol-4-yl]methylidene]-3-methyl-5-oxopyrazol-1-yl]benzoate Traditional Name: 4-[(4E)-4-[[3,5-dimethyl-1-(p-tolyl)pyrazol-4-yl]methylene]-5-keto-3-methyl-2-pyrazolin-1-yl]benzoate Formula: C24H21N4O3- MolecularWeight: 413.44854

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=C(C(=N2)C)C=C3C(=NN(C3=O)C4=CC=C(C=C4)C(=O)[O-])C)C

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=C(C(=N2)C)/C=C/3\C(=NN(C3=O)C4=CC=C(C=C4)C(=O)[O-])C)C

InChI

InChI=1S/C24H22N4O3/c1-14-5-9-19(10-6-14)27-17(4)21(15(2)25-27)13-22-16(3)26-28(23(22)29)20-11-7-18(8-12-20)24(30)31/h5-13H,1-4H3,(H,30,31)/p-1/b22-13+