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

Systemtic Name: (2S)-2-(3-ethoxyphenyl)-2-(3-oxidanylpropylamino)ethanenitrile Openeye Name: (2S)-2-(3-ethoxyphenyl)-2-(3-hydroxypropylamino)acetonitrile CAS Name: (2S)-2-(3-ethoxyphenyl)-2-(3-hydroxypropylamino)acetonitrile IUPAC Name: (2S)-2-(3-ethoxyphenyl)-2-(3-hydroxypropylamino)acetonitrile Traditional Name: (2S)-2-(3-hydroxypropylamino)-2-m-phenetyl-acetonitrile Formula: C13H18N2O2 MolecularWeight: 234.29422

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H18N2O2/c1-2-17-12-6-3-5-11(9-12)13(10-14)15-7-4-8-16/h3,5-6,9,13,15-16H,2,4,7-8H2,1H3/t13-/m1/s1