2-[[(2S)-3-methyl-1-oxidanyl-butan-2-yl]-(phenylmethyl)amino]ethanenitrile

Systemtic Name: 2-[[(2S)-3-methyl-1-oxidanyl-butan-2-yl]-(phenylmethyl)amino]ethanenitrile Openeye Name: 2-[benzyl-[(1S)-1-(hydroxymethyl)-2-methyl-propyl]amino]acetonitrile CAS Name: 2-[[(2S)-1-hydroxy-3-methylbutan-2-yl]-(phenylmethyl)amino]acetonitrile IUPAC Name: 2-[benzyl-[(2S)-1-hydroxy-3-methylbutan-2-yl]amino]acetonitrile Traditional Name: 2-[benzyl-[(1S)-2-methyl-1-methylol-propyl]amino]acetonitrile Formula: C14H20N2O MolecularWeight: 232.3214

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H20N2O/c1-12(2)14(11-17)16(9-8-15)10-13-6-4-3-5-7-13/h3-7,12,14,17H,9-11H2,1-2H3/t14-/m1/s1