(4Z)-5-methyl-2-(2-phenylethanoyl)-4-[(E)-3-phenylprop-2-enylidene]pyrazol-3-one

Systemtic Name: (4Z)-5-methyl-2-(2-phenylethanoyl)-4-[(E)-3-phenylprop-2-enylidene]pyrazol-3-one Openeye Name: (4Z)-5-methyl-2-(2-phenylacetyl)-4-[(E)-3-phenylprop-2-enylidene]pyrazol-3-one CAS Name: (4Z)-5-methyl-2-(1-oxo-2-phenylethyl)-4-[(E)-3-phenylprop-2-enylidene]-3-pyrazolone IUPAC Name: (4Z)-5-methyl-2-(2-phenylacetyl)-4-[(E)-3-phenylprop-2-enylidene]pyrazol-3-one Traditional Name: (4Z)-5-methyl-2-(2-phenylacetyl)-4-[(E)-3-phenylprop-2-enylidene]-2-pyrazolin-3-one Formula: C21H18N2O2 MolecularWeight: 330.37982

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1=CC=CC2=CC=CC=C2)C(=O)CC3=CC=CC=C3

Isomeric SMILES

CC\1=NN(C(=O)/C1=C\C=C\C2=CC=CC=C2)C(=O)CC3=CC=CC=C3

InChI

InChI=1S/C21H18N2O2/c1-16-19(14-8-13-17-9-4-2-5-10-17)21(25)23(22-16)20(24)15-18-11-6-3-7-12-18/h2-14H,15H2,1H3/b13-8+,19-14-