2-[[(2S)-4-methyl-1-oxidanyl-pentan-2-yl]-(phenylmethyl)amino]ethanenitrile

Systemtic Name: 2-[[(2S)-4-methyl-1-oxidanyl-pentan-2-yl]-(phenylmethyl)amino]ethanenitrile Openeye Name: 2-[benzyl-[(1S)-1-(hydroxymethyl)-3-methyl-butyl]amino]acetonitrile CAS Name: 2-[[(2S)-1-hydroxy-4-methylpentan-2-yl]-(phenylmethyl)amino]acetonitrile IUPAC Name: 2-[benzyl-[(2S)-1-hydroxy-4-methylpentan-2-yl]amino]acetonitrile Traditional Name: 2-[benzyl-[(1S)-3-methyl-1-methylol-butyl]amino]acetonitrile Formula: C15H22N2O MolecularWeight: 246.34798

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H22N2O/c1-13(2)10-15(12-18)17(9-8-16)11-14-6-4-3-5-7-14/h3-7,13,15,18H,9-12H2,1-2H3/t15-/m0/s1