2-[(2R,4S)-4-butyl-1-(phenylmethyl)pyrrolidin-2-yl]ethanenitrile

Systemtic Name: 2-[(2R,4S)-4-butyl-1-(phenylmethyl)pyrrolidin-2-yl]ethanenitrile Openeye Name: 2-[(2R,4S)-1-benzyl-4-butyl-pyrrolidin-2-yl]acetonitrile CAS Name: 2-[(2R,4S)-4-butyl-1-(phenylmethyl)-2-pyrrolidinyl]acetonitrile IUPAC Name: 2-[(2R,4S)-1-benzyl-4-butylpyrrolidin-2-yl]acetonitrile Traditional Name: 2-[(2R,4S)-1-benzyl-4-butyl-pyrrolidin-2-yl]acetonitrile Formula: C17H24N2 MolecularWeight: 256.38586

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CC(N(C1)CC2=CC=CC=C2)CC#N

Isomeric SMILES

CCCC[C@H]1C[C@@H](N(C1)CC2=CC=CC=C2)CC#N

InChI

InChI=1S/C17H24N2/c1-2-3-7-16-12-17(10-11-18)19(14-16)13-15-8-5-4-6-9-15/h4-6,8-9,16-17H,2-3,7,10,12-14H2,1H3/t16-,17-/m0/s1