(E)-N-(3-chlorophenyl)-2-cyano-3-[4-(phenylmethyl)piperidin-1-yl]prop-2-enamide

Systemtic Name: (E)-N-(3-chlorophenyl)-2-cyano-3-[4-(phenylmethyl)piperidin-1-yl]prop-2-enamide Openeye Name: (E)-3-(4-benzyl-1-piperidyl)-N-(3-chlorophenyl)-2-cyano-prop-2-enamide CAS Name: (E)-N-(3-chlorophenyl)-2-cyano-3-[4-(phenylmethyl)-1-piperidinyl]-2-propenamide IUPAC Name: (E)-3-(4-benzylpiperidin-1-yl)-N-(3-chlorophenyl)-2-cyanoprop-2-enamide Traditional Name: (E)-3-(4-benzylpiperidino)-N-(3-chlorophenyl)-2-cyano-acrylamide Formula: C22H22ClN3O MolecularWeight: 379.88258

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CC2=CC=CC=C2)C=C(C#N)C(=O)NC3=CC(=CC=C3)Cl

Isomeric SMILES

C1CN(CCC1CC2=CC=CC=C2)/C=C(\C#N)/C(=O)NC3=CC(=CC=C3)Cl

InChI

InChI=1S/C22H22ClN3O/c23-20-7-4-8-21(14-20)25-22(27)19(15-24)16-26-11-9-18(10-12-26)13-17-5-2-1-3-6-17/h1-8,14,16,18H,9-13H2,(H,25,27)/b19-16+