(2S)-2-(2,4-dichlorophenyl)-2-(3-oxidanylpropylamino)ethanenitrile

Systemtic Name: (2S)-2-(2,4-dichlorophenyl)-2-(3-oxidanylpropylamino)ethanenitrile Openeye Name: (2S)-2-(2,4-dichlorophenyl)-2-(3-hydroxypropylamino)acetonitrile CAS Name: (2S)-2-(2,4-dichlorophenyl)-2-(3-hydroxypropylamino)acetonitrile IUPAC Name: (2S)-2-(2,4-dichlorophenyl)-2-(3-hydroxypropylamino)acetonitrile Traditional Name: (2S)-2-(2,4-dichlorophenyl)-2-(3-hydroxypropylamino)acetonitrile Formula: C11H12Cl2N2O MolecularWeight: 259.13178

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1Cl)Cl)C(C#N)NCCCO

Isomeric SMILES

C1=CC(=C(C=C1Cl)Cl)[C@@H](C#N)NCCCO

InChI

InChI=1S/C11H12Cl2N2O/c12-8-2-3-9(10(13)6-8)11(7-14)15-4-1-5-16/h2-3,6,11,15-16H,1,4-5H2/t11-/m1/s1