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

Systemtic Name: 4-[(4E)-4-[[3,5-dimethyl-1-(phenylmethyl)pyrazol-4-yl]methylidene]-3-methyl-5-oxidanylidene-pyrazol-1-yl]benzoate Openeye Name: 4-[(4E)-4-[(1-benzyl-3,5-dimethyl-pyrazol-4-yl)methylene]-3-methyl-5-oxo-pyrazol-1-yl]benzoate CAS Name: 4-[(4E)-4-[[3,5-dimethyl-1-(phenylmethyl)-4-pyrazolyl]methylidene]-3-methyl-5-oxo-1-pyrazolyl]benzoate IUPAC Name: 4-[(4E)-4-[(1-benzyl-3,5-dimethylpyrazol-4-yl)methylidene]-3-methyl-5-oxopyrazol-1-yl]benzoate Traditional Name: 4-[(4E)-4-[(1-benzyl-3,5-dimethyl-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=C(C(=NN1CC2=CC=CC=C2)C)C=C3C(=NN(C3=O)C4=CC=C(C=C4)C(=O)[O-])C

Isomeric SMILES

CC1=C(C(=NN1CC2=CC=CC=C2)C)/C=C/3\C(=NN(C3=O)C4=CC=C(C=C4)C(=O)[O-])C

InChI

InChI=1S/C24H22N4O3/c1-15-21(17(3)27(25-15)14-18-7-5-4-6-8-18)13-22-16(2)26-28(23(22)29)20-11-9-19(10-12-20)24(30)31/h4-13H,14H2,1-3H3,(H,30,31)/p-1/b22-13+