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

Systemtic Name: (2S)-2-(3-methylbutylamino)-2-(3-propoxyphenyl)ethanenitrile Openeye Name: (2S)-2-(isopentylamino)-2-(3-propoxyphenyl)acetonitrile CAS Name: (2S)-2-(3-methylbutylamino)-2-(3-propoxyphenyl)acetonitrile IUPAC Name: (2S)-2-(3-methylbutylamino)-2-(3-propoxyphenyl)acetonitrile Traditional Name: (2S)-2-(isoamylamino)-2-(3-propoxyphenyl)acetonitrile Formula: C16H24N2O MolecularWeight: 260.37456

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=CC(=C1)C(C#N)NCCC(C)C

Isomeric SMILES

CCCOC1=CC=CC(=C1)[C@@H](C#N)NCCC(C)C

InChI

InChI=1S/C16H24N2O/c1-4-10-19-15-7-5-6-14(11-15)16(12-17)18-9-8-13(2)3/h5-7,11,13,16,18H,4,8-10H2,1-3H3/t16-/m1/s1