(Z)-2-(4-chlorophenyl)-3-(2-methoxy-4-piperidin-1-yl-phenyl)prop-2-enenitrile

Systemtic Name: (Z)-2-(4-chlorophenyl)-3-(2-methoxy-4-piperidin-1-yl-phenyl)prop-2-enenitrile Openeye Name: (Z)-2-(4-chlorophenyl)-3-[2-methoxy-4-(1-piperidyl)phenyl]prop-2-enenitrile CAS Name: (Z)-2-(4-chlorophenyl)-3-[2-methoxy-4-(1-piperidinyl)phenyl]-2-propenenitrile IUPAC Name: (Z)-2-(4-chlorophenyl)-3-(2-methoxy-4-piperidin-1-ylphenyl)prop-2-enenitrile Traditional Name: (Z)-2-(4-chlorophenyl)-3-(2-methoxy-4-piperidino-phenyl)acrylonitrile Formula: C21H21ClN2O MolecularWeight: 352.85724

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)N2CCCCC2)C=C(C#N)C3=CC=C(C=C3)Cl

Isomeric SMILES

COC1=C(C=CC(=C1)N2CCCCC2)/C=C(\C#N)/C3=CC=C(C=C3)Cl

InChI

InChI=1S/C21H21ClN2O/c1-25-21-14-20(24-11-3-2-4-12-24)10-7-17(21)13-18(15-23)16-5-8-19(22)9-6-16/h5-10,13-14H,2-4,11-12H2,1H3/b18-13+