2-[4-[(2S)-3-azanyl-2-oxidanyl-propoxy]phenyl]ethanenitrile

Systemtic Name: 2-[4-[(2S)-3-azanyl-2-oxidanyl-propoxy]phenyl]ethanenitrile Openeye Name: 2-[4-[(2S)-3-amino-2-hydroxy-propoxy]phenyl]acetonitrile CAS Name: 2-[4-[(2S)-3-amino-2-hydroxypropoxy]phenyl]acetonitrile IUPAC Name: 2-[4-[(2S)-3-amino-2-hydroxypropoxy]phenyl]acetonitrile Traditional Name: 2-[4-[(2S)-3-amino-2-hydroxy-propoxy]phenyl]acetonitrile Formula: C11H14N2O2 MolecularWeight: 206.24106

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC#N)OCC(CN)O

Isomeric SMILES

C1=CC(=CC=C1CC#N)OC[C@H](CN)O

InChI

InChI=1S/C11H14N2O2/c12-6-5-9-1-3-11(4-2-9)15-8-10(14)7-13/h1-4,10,14H,5,7-8,13H2/t10-/m0/s1