2-[1-[3-(4-butylpiperidin-1-yl)propyl]indol-3-yl]ethanenitrile

Systemtic Name: 2-[1-[3-(4-butylpiperidin-1-yl)propyl]indol-3-yl]ethanenitrile Openeye Name: 2-[1-[3-(4-butyl-1-piperidyl)propyl]indol-3-yl]acetonitrile CAS Name: 2-[1-[3-(4-butyl-1-piperidinyl)propyl]-3-indolyl]acetonitrile IUPAC Name: 2-[1-[3-(4-butylpiperidin-1-yl)propyl]indol-3-yl]acetonitrile Traditional Name: 2-[1-[3-(4-butylpiperidino)propyl]indol-3-yl]acetonitrile Formula: C22H31N3 MolecularWeight: 337.50164

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CCN(CC1)CCCN2C=C(C3=CC=CC=C32)CC#N

Isomeric SMILES

CCCCC1CCN(CC1)CCCN2C=C(C3=CC=CC=C32)CC#N

InChI

InChI=1S/C22H31N3/c1-2-3-7-19-11-16-24(17-12-19)14-6-15-25-18-20(10-13-23)21-8-4-5-9-22(21)25/h4-5,8-9,18-19H,2-3,6-7,10-12,14-17H2,1H3