(2S)-2-(3-ethoxyphenyl)-2-(3-methylbutylamino)ethanenitrile

Systemtic Name: (2S)-2-(3-ethoxyphenyl)-2-(3-methylbutylamino)ethanenitrile Openeye Name: (2S)-2-(3-ethoxyphenyl)-2-(isopentylamino)acetonitrile CAS Name: (2S)-2-(3-ethoxyphenyl)-2-(3-methylbutylamino)acetonitrile IUPAC Name: (2S)-2-(3-ethoxyphenyl)-2-(3-methylbutylamino)acetonitrile Traditional Name: (2S)-2-(isoamylamino)-2-m-phenetyl-acetonitrile Formula: C15H22N2O MolecularWeight: 246.34798

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1)C(C#N)NCCC(C)C

Isomeric SMILES

CCOC1=CC=CC(=C1)[C@@H](C#N)NCCC(C)C

InChI

InChI=1S/C15H22N2O/c1-4-18-14-7-5-6-13(10-14)15(11-16)17-9-8-12(2)3/h5-7,10,12,15,17H,4,8-9H2,1-3H3/t15-/m1/s1