(4E)-2-(3,4-dichlorophenyl)-5-methyl-4-(phenylmethylidene)pyrazol-3-one

Systemtic Name: (4E)-2-(3,4-dichlorophenyl)-5-methyl-4-(phenylmethylidene)pyrazol-3-one Openeye Name: (4E)-4-benzylidene-2-(3,4-dichlorophenyl)-5-methyl-pyrazol-3-one CAS Name: (4E)-2-(3,4-dichlorophenyl)-5-methyl-4-(phenylmethylene)-3-pyrazolone IUPAC Name: (4E)-4-benzylidene-2-(3,4-dichlorophenyl)-5-methylpyrazol-3-one Traditional Name: (4E)-4-benzal-2-(3,4-dichlorophenyl)-5-methyl-2-pyrazolin-3-one Formula: C17H12Cl2N2O MolecularWeight: 331.19598

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H12Cl2N2O/c1-11-14(9-12-5-3-2-4-6-12)17(22)21(20-11)13-7-8-15(18)16(19)10-13/h2-10H,1H3/b14-9+