(2S)-2-(methylamino)-2-(4-propoxyphenyl)ethanenitrile

Systemtic Name: (2S)-2-(methylamino)-2-(4-propoxyphenyl)ethanenitrile Openeye Name: (2S)-2-(methylamino)-2-(4-propoxyphenyl)acetonitrile CAS Name: (2S)-2-(methylamino)-2-(4-propoxyphenyl)acetonitrile IUPAC Name: (2S)-2-(methylamino)-2-(4-propoxyphenyl)acetonitrile Traditional Name: (2S)-2-(methylamino)-2-(4-propoxyphenyl)acetonitrile Formula: C12H16N2O MolecularWeight: 204.26824

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H16N2O/c1-3-8-15-11-6-4-10(5-7-11)12(9-13)14-2/h4-7,12,14H,3,8H2,1-2H3/t12-/m1/s1