(2S)-2-(3-oxidanylpropylamino)-2-(4-propan-2-yloxyphenyl)ethanenitrile

Systemtic Name: (2S)-2-(3-oxidanylpropylamino)-2-(4-propan-2-yloxyphenyl)ethanenitrile Openeye Name: (2S)-2-(3-hydroxypropylamino)-2-(4-isopropoxyphenyl)acetonitrile CAS Name: (2S)-2-(3-hydroxypropylamino)-2-(4-propan-2-yloxyphenyl)acetonitrile IUPAC Name: (2S)-2-(3-hydroxypropylamino)-2-(4-propan-2-yloxyphenyl)acetonitrile Traditional Name: (2S)-2-(3-hydroxypropylamino)-2-(4-isopropoxyphenyl)acetonitrile Formula: C14H20N2O2 MolecularWeight: 248.3208

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=C(C=C1)C(C#N)NCCCO

Isomeric SMILES

CC(C)OC1=CC=C(C=C1)[C@@H](C#N)NCCCO

InChI

InChI=1S/C14H20N2O2/c1-11(2)18-13-6-4-12(5-7-13)14(10-15)16-8-3-9-17/h4-7,11,14,16-17H,3,8-9H2,1-2H3/t14-/m1/s1