2,2-dimethyl-3-oxidanyl-6-phenylmethoxy-hexanenitrile

Systemtic Name: 2,2-dimethyl-3-oxidanyl-6-phenylmethoxy-hexanenitrile Openeye Name: 6-benzyloxy-3-hydroxy-2,2-dimethyl-hexanenitrile CAS Name: 3-hydroxy-2,2-dimethyl-6-phenylmethoxyhexanenitrile IUPAC Name: 3-hydroxy-2,2-dimethyl-6-phenylmethoxyhexanenitrile Traditional Name: 6-benzoxy-3-hydroxy-2,2-dimethyl-hexanenitrile Formula: C15H21NO2 MolecularWeight: 247.33274

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C#N)C(CCCOCC1=CC=CC=C1)O

Isomeric SMILES

CC(C)(C#N)C(CCCOCC1=CC=CC=C1)O

InChI

InChI=1S/C15H21NO2/c1-15(2,12-16)14(17)9-6-10-18-11-13-7-4-3-5-8-13/h3-5,7-8,14,17H,6,9-11H2,1-2H3