2-[(4-chlorophenyl)methyl]-4-(phenylmethyl)-1H-pyrazol-3-one

Systemtic Name: 2-[(4-chlorophenyl)methyl]-4-(phenylmethyl)-1H-pyrazol-3-one Openeye Name: 4-benzyl-2-[(4-chlorophenyl)methyl]-1H-pyrazol-3-one CAS Name: 2-[(4-chlorophenyl)methyl]-4-(phenylmethyl)-1H-pyrazol-3-one IUPAC Name: 4-benzyl-2-[(4-chlorophenyl)methyl]-1H-pyrazol-3-one Traditional Name: 4-benzyl-2-(4-chlorobenzyl)-3-pyrazolin-3-one Formula: C17H15ClN2O MolecularWeight: 298.7668

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=CNN(C2=O)CC3=CC=C(C=C3)Cl

Isomeric SMILES

C1=CC=C(C=C1)CC2=CNN(C2=O)CC3=CC=C(C=C3)Cl

InChI

InChI=1S/C17H15ClN2O/c18-16-8-6-14(7-9-16)12-20-17(21)15(11-19-20)10-13-4-2-1-3-5-13/h1-9,11,19H,10,12H2