4-[1,2-bis(oxidanyl)propan-2-yl]benzenecarbonitrile

Systemtic Name: 4-[1,2-bis(oxidanyl)propan-2-yl]benzenecarbonitrile Openeye Name: 4-(1,2-dihydroxy-1-methyl-ethyl)benzonitrile CAS Name: 4-(1,2-dihydroxypropan-2-yl)benzonitrile IUPAC Name: 4-(1,2-dihydroxypropan-2-yl)benzonitrile Traditional Name: 4-(1,2-dihydroxy-1-methyl-ethyl)benzonitrile Formula: C10H11NO2 MolecularWeight: 177.19984

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CO)(C1=CC=C(C=C1)C#N)O

Isomeric SMILES

CC(CO)(C1=CC=C(C=C1)C#N)O

InChI

InChI=1S/C10H11NO2/c1-10(13,7-12)9-4-2-8(6-11)3-5-9/h2-5,12-13H,7H2,1H3