1-[3-(3,4-dimethoxyphenyl)propanoyl]piperidine-4-carbonitrile

Systemtic Name: 1-[3-(3,4-dimethoxyphenyl)propanoyl]piperidine-4-carbonitrile Openeye Name: 1-[3-(3,4-dimethoxyphenyl)propanoyl]piperidine-4-carbonitrile CAS Name: 1-[3-(3,4-dimethoxyphenyl)-1-oxopropyl]-4-piperidinecarbonitrile IUPAC Name: 1-[3-(3,4-dimethoxyphenyl)propanoyl]piperidine-4-carbonitrile Traditional Name: 1-[3-(3,4-dimethoxyphenyl)propanoyl]isonipecotonitrile Formula: C17H22N2O3 MolecularWeight: 302.36818

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCC(=O)N2CCC(CC2)C#N)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCC(=O)N2CCC(CC2)C#N)OC

InChI

InChI=1S/C17H22N2O3/c1-21-15-5-3-13(11-16(15)22-2)4-6-17(20)19-9-7-14(12-18)8-10-19/h3,5,11,14H,4,6-10H2,1-2H3