2-[4-[2-(3,3,5,5-tetramethylcyclohexen-1-yl)phenyl]piperazin-1-yl]ethanenitrile

Systemtic Name: 2-[4-[2-(3,3,5,5-tetramethylcyclohexen-1-yl)phenyl]piperazin-1-yl]ethanenitrile Openeye Name: 2-[4-[2-(3,3,5,5-tetramethylcyclohexen-1-yl)phenyl]piperazin-1-yl]acetonitrile CAS Name: 2-[4-[2-(3,3,5,5-tetramethyl-1-cyclohexenyl)phenyl]-1-piperazinyl]acetonitrile IUPAC Name: 2-[4-[2-(3,3,5,5-tetramethylcyclohexen-1-yl)phenyl]piperazin-1-yl]acetonitrile Traditional Name: 2-[4-[2-(3,3,5,5-tetramethylcyclohexen-1-yl)phenyl]piperazino]acetonitrile Formula: C22H31N3 MolecularWeight: 337.50164

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=CC(C1)(C)C)C2=CC=CC=C2N3CCN(CC3)CC#N)C

Isomeric SMILES

CC1(CC(=CC(C1)(C)C)C2=CC=CC=C2N3CCN(CC3)CC#N)C

InChI

InChI=1S/C22H31N3/c1-21(2)15-18(16-22(3,4)17-21)19-7-5-6-8-20(19)25-13-11-24(10-9-23)12-14-25/h5-8,15H,10-14,16-17H2,1-4H3