2-[2-(3,4-dimethoxyphenyl)ethyl]-1-(phenylcarbonyl)piperidine-2-carbonitrile

Systemtic Name: 2-[2-(3,4-dimethoxyphenyl)ethyl]-1-(phenylcarbonyl)piperidine-2-carbonitrile Openeye Name: 1-benzoyl-2-[2-(3,4-dimethoxyphenyl)ethyl]piperidine-2-carbonitrile CAS Name: 1-benzoyl-2-[2-(3,4-dimethoxyphenyl)ethyl]-2-piperidinecarbonitrile IUPAC Name: 1-benzoyl-2-[2-(3,4-dimethoxyphenyl)ethyl]piperidine-2-carbonitrile Traditional Name: 1-benzoyl-2-homoveratryl-pipecolinonitrile Formula: C23H26N2O3 MolecularWeight: 378.46414

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCC2(CCCCN2C(=O)C3=CC=CC=C3)C#N)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCC2(CCCCN2C(=O)C3=CC=CC=C3)C#N)OC

InChI

InChI=1S/C23H26N2O3/c1-27-20-11-10-18(16-21(20)28-2)12-14-23(17-24)13-6-7-15-25(23)22(26)19-8-4-3-5-9-19/h3-5,8-11,16H,6-7,12-15H2,1-2H3