(E,4Z)-1-(1-methylpyrazol-3-yl)-4-(phenylmethylidene)non-2-en-1-one

Systemtic Name: (E,4Z)-1-(1-methylpyrazol-3-yl)-4-(phenylmethylidene)non-2-en-1-one Openeye Name: (E,4Z)-4-benzylidene-1-(1-methylpyrazol-3-yl)non-2-en-1-one CAS Name: (E,4Z)-1-(1-methyl-3-pyrazolyl)-4-(phenylmethylene)-2-nonen-1-one IUPAC Name: (E,4Z)-4-benzylidene-1-(1-methylpyrazol-3-yl)non-2-en-1-one Traditional Name: (2E,4Z)-4-amyl-1-(1-methylpyrazol-3-yl)-5-phenyl-penta-2,4-dien-1-one Formula: C20H24N2O MolecularWeight: 308.41736

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=CC1=CC=CC=C1)C=CC(=O)C2=NN(C=C2)C

Isomeric SMILES

CCCCC/C(=C/C1=CC=CC=C1)/C=C/C(=O)C2=NN(C=C2)C

InChI

InChI=1S/C20H24N2O/c1-3-4-6-9-18(16-17-10-7-5-8-11-17)12-13-20(23)19-14-15-22(2)21-19/h5,7-8,10-16H,3-4,6,9H2,1-2H3/b13-12+,18-16-