(2S)-2-(4-bromophenyl)-2-(3-oxidanylpropylamino)ethanenitrile

Systemtic Name: (2S)-2-(4-bromophenyl)-2-(3-oxidanylpropylamino)ethanenitrile Openeye Name: (2S)-2-(4-bromophenyl)-2-(3-hydroxypropylamino)acetonitrile CAS Name: (2S)-2-(4-bromophenyl)-2-(3-hydroxypropylamino)acetonitrile IUPAC Name: (2S)-2-(4-bromophenyl)-2-(3-hydroxypropylamino)acetonitrile Traditional Name: (2S)-2-(4-bromophenyl)-2-(3-hydroxypropylamino)acetonitrile Formula: C11H13BrN2O MolecularWeight: 269.13772

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(C#N)NCCCO)Br

Isomeric SMILES

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

InChI

InChI=1S/C11H13BrN2O/c12-10-4-2-9(3-5-10)11(8-13)14-6-1-7-15/h2-5,11,14-15H,1,6-7H2/t11-/m1/s1