4-[[(2S)-2,3-bis(oxidanyl)propyl]amino]benzenecarbonitrile

Systemtic Name: 4-[[(2S)-2,3-bis(oxidanyl)propyl]amino]benzenecarbonitrile Openeye Name: 4-[[(2S)-2,3-dihydroxypropyl]amino]benzonitrile CAS Name: 4-[[(2S)-2,3-dihydroxypropyl]amino]benzonitrile IUPAC Name: 4-[[(2S)-2,3-dihydroxypropyl]amino]benzonitrile Traditional Name: 4-[[(2S)-2,3-dihydroxypropyl]amino]benzonitrile Formula: C10H12N2O2 MolecularWeight: 192.21448

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C#N)NCC(CO)O

Isomeric SMILES

C1=CC(=CC=C1C#N)NC[C@@H](CO)O

InChI

InChI=1S/C10H12N2O2/c11-5-8-1-3-9(4-2-8)12-6-10(14)7-13/h1-4,10,12-14H,6-7H2/t10-/m0/s1