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

Systemtic Name: (2S)-2-(butylamino)-2-(3-ethoxyphenyl)ethanenitrile Openeye Name: (2S)-2-(butylamino)-2-(3-ethoxyphenyl)acetonitrile CAS Name: (2S)-2-(butylamino)-2-(3-ethoxyphenyl)acetonitrile IUPAC Name: (2S)-2-(butylamino)-2-(3-ethoxyphenyl)acetonitrile Traditional Name: (2S)-2-(butylamino)-2-m-phenetyl-acetonitrile Formula: C14H20N2O MolecularWeight: 232.3214

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(C#N)C1=CC(=CC=C1)OCC

Isomeric SMILES

CCCCN[C@H](C#N)C1=CC(=CC=C1)OCC

InChI

InChI=1S/C14H20N2O/c1-3-5-9-16-14(11-15)12-7-6-8-13(10-12)17-4-2/h6-8,10,14,16H,3-5,9H2,1-2H3/t14-/m1/s1