(2S)-2-(butylamino)-2-phenyl-ethanenitrile

Systemtic Name: (2S)-2-(butylamino)-2-phenyl-ethanenitrile Openeye Name: (2S)-2-(butylamino)-2-phenyl-acetonitrile CAS Name: (2S)-2-(butylamino)-2-phenylacetonitrile IUPAC Name: (2S)-2-(butylamino)-2-phenylacetonitrile Traditional Name: (2S)-2-(butylamino)-2-phenyl-acetonitrile Formula: C12H16N2 MolecularWeight: 188.26884

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H16N2/c1-2-3-9-14-12(10-13)11-7-5-4-6-8-11/h4-8,12,14H,2-3,9H2,1H3/t12-/m1/s1