(4E)-2-(4-chlorophenyl)-5-methyl-4-[[(phenylmethyl)amino]methylidene]pyrazol-3-one

Systemtic Name: (4E)-2-(4-chlorophenyl)-5-methyl-4-[[(phenylmethyl)amino]methylidene]pyrazol-3-one Openeye Name: (4E)-4-[(benzylamino)methylene]-2-(4-chlorophenyl)-5-methyl-pyrazol-3-one CAS Name: (4E)-2-(4-chlorophenyl)-5-methyl-4-[[(phenylmethyl)amino]methylidene]-3-pyrazolone IUPAC Name: (4E)-4-[(benzylamino)methylidene]-2-(4-chlorophenyl)-5-methylpyrazol-3-one Traditional Name: (4E)-4-[(benzylamino)methylene]-2-(4-chlorophenyl)-5-methyl-2-pyrazolin-3-one Formula: C18H16ClN3O MolecularWeight: 325.79214

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1=CNCC2=CC=CC=C2)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC\1=NN(C(=O)/C1=C/NCC2=CC=CC=C2)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C18H16ClN3O/c1-13-17(12-20-11-14-5-3-2-4-6-14)18(23)22(21-13)16-9-7-15(19)8-10-16/h2-10,12,20H,11H2,1H3/b17-12+