(3S)-3-(2-methylphenyl)-3-oxidanyl-propanenitrile

Systemtic Name: (3S)-3-(2-methylphenyl)-3-oxidanyl-propanenitrile Openeye Name: (3S)-3-hydroxy-3-(o-tolyl)propanenitrile CAS Name: (3S)-3-hydroxy-3-(2-methylphenyl)propanenitrile IUPAC Name: (3S)-3-hydroxy-3-(2-methylphenyl)propanenitrile Traditional Name: (3S)-3-hydroxy-3-(o-tolyl)propionitrile Formula: C10H11NO MolecularWeight: 161.20044

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(CC#N)O

Isomeric SMILES

CC1=CC=CC=C1[C@H](CC#N)O

InChI

InChI=1S/C10H11NO/c1-8-4-2-3-5-9(8)10(12)6-7-11/h2-5,10,12H,6H2,1H3/t10-/m0/s1