(2R,3S)-2-[tert-butyl-(phenylmethyl)amino]-4,4-dimethyl-3-oxidanyl-pentanenitrile

Systemtic Name: (2R,3S)-2-[tert-butyl-(phenylmethyl)amino]-4,4-dimethyl-3-oxidanyl-pentanenitrile Openeye Name: (2R,3S)-2-[benzyl(tert-butyl)amino]-3-hydroxy-4,4-dimethyl-pentanenitrile CAS Name: (2R,3S)-2-[tert-butyl-(phenylmethyl)amino]-3-hydroxy-4,4-dimethylpentanenitrile IUPAC Name: (2R,3S)-2-[benzyl(tert-butyl)amino]-3-hydroxy-4,4-dimethylpentanenitrile Traditional Name: (2R,3S)-2-[benzyl(tert-butyl)amino]-3-hydroxy-4,4-dimethyl-valeronitrile Formula: C18H28N2O MolecularWeight: 288.42772

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H28N2O/c1-17(2,3)16(21)15(12-19)20(18(4,5)6)13-14-10-8-7-9-11-14/h7-11,15-16,21H,13H2,1-6H3/t15-,16-/m1/s1