2-[4-[(2,5-dimethylpiperidin-1-yl)methyl]phenyl]ethanenitrile

Systemtic Name: 2-[4-[(2,5-dimethylpiperidin-1-yl)methyl]phenyl]ethanenitrile Openeye Name: 2-[4-[(2,5-dimethyl-1-piperidyl)methyl]phenyl]acetonitrile CAS Name: 2-[4-[(2,5-dimethyl-1-piperidinyl)methyl]phenyl]acetonitrile IUPAC Name: 2-[4-[(2,5-dimethylpiperidin-1-yl)methyl]phenyl]acetonitrile Traditional Name: 2-[4-[(2,5-dimethylpiperidino)methyl]phenyl]acetonitrile Formula: C16H22N2 MolecularWeight: 242.35928

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(N(C1)CC2=CC=C(C=C2)CC#N)C

Isomeric SMILES

CC1CCC(N(C1)CC2=CC=C(C=C2)CC#N)C

InChI

InChI=1S/C16H22N2/c1-13-3-4-14(2)18(11-13)12-16-7-5-15(6-8-16)9-10-17/h5-8,13-14H,3-4,9,11-12H2,1-2H3