(2R,3S)-2-[tert-butyl-(phenylmethyl)amino]-3-cyclohexyl-3-oxidanyl-propanenitrile

Systemtic Name: (2R,3S)-2-[tert-butyl-(phenylmethyl)amino]-3-cyclohexyl-3-oxidanyl-propanenitrile Openeye Name: (2R,3S)-2-[benzyl(tert-butyl)amino]-3-cyclohexyl-3-hydroxy-propanenitrile CAS Name: (2R,3S)-2-[tert-butyl-(phenylmethyl)amino]-3-cyclohexyl-3-hydroxypropanenitrile IUPAC Name: (2R,3S)-2-[benzyl(tert-butyl)amino]-3-cyclohexyl-3-hydroxypropanenitrile Traditional Name: (2R,3S)-2-[benzyl(tert-butyl)amino]-3-cyclohexyl-3-hydroxy-propionitrile Formula: C20H30N2O MolecularWeight: 314.465

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N(CC1=CC=CC=C1)C(C#N)C(C2CCCCC2)O

Isomeric SMILES

CC(C)(C)N(CC1=CC=CC=C1)[C@H](C#N)[C@H](C2CCCCC2)O

InChI

InChI=1S/C20H30N2O/c1-20(2,3)22(15-16-10-6-4-7-11-16)18(14-21)19(23)17-12-8-5-9-13-17/h4,6-7,10-11,17-19,23H,5,8-9,12-13,15H2,1-3H3/t18-,19+/m1/s1