(4E)-2-(3-chlorophenyl)-5-methyl-4-(piperidin-1-ylmethylidene)pyrazol-3-one

Systemtic Name: (4E)-2-(3-chlorophenyl)-5-methyl-4-(piperidin-1-ylmethylidene)pyrazol-3-one Openeye Name: (4E)-2-(3-chlorophenyl)-5-methyl-4-(1-piperidylmethylene)pyrazol-3-one CAS Name: (4E)-2-(3-chlorophenyl)-5-methyl-4-(1-piperidinylmethylidene)-3-pyrazolone IUPAC Name: (4E)-2-(3-chlorophenyl)-5-methyl-4-(piperidin-1-ylmethylidene)pyrazol-3-one Traditional Name: (4E)-2-(3-chlorophenyl)-5-methyl-4-(piperidinomethylene)-2-pyrazolin-3-one Formula: C16H18ClN3O MolecularWeight: 303.78662

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1=CN2CCCCC2)C3=CC(=CC=C3)Cl

Isomeric SMILES

CC\1=NN(C(=O)/C1=C/N2CCCCC2)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C16H18ClN3O/c1-12-15(11-19-8-3-2-4-9-19)16(21)20(18-12)14-7-5-6-13(17)10-14/h5-7,10-11H,2-4,8-9H2,1H3/b15-11+