3-[(2S)-3-azanyl-2-oxidanyl-propoxy]benzenecarbonitrile

Systemtic Name: 3-[(2S)-3-azanyl-2-oxidanyl-propoxy]benzenecarbonitrile Openeye Name: 3-[(2S)-3-amino-2-hydroxy-propoxy]benzonitrile CAS Name: 3-[(2S)-3-amino-2-hydroxypropoxy]benzonitrile IUPAC Name: 3-[(2S)-3-amino-2-hydroxypropoxy]benzonitrile Traditional Name: 3-[(2S)-3-amino-2-hydroxy-propoxy]benzonitrile Formula: C10H12N2O2 MolecularWeight: 192.21448

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H12N2O2/c11-5-8-2-1-3-10(4-8)14-7-9(13)6-12/h1-4,9,13H,6-7,12H2/t9-/m0/s1