4-methoxy-2-[3-(2-methylpropoxy)phenyl]-3-oxidanyl-butanenitrile

Systemtic Name: 4-methoxy-2-[3-(2-methylpropoxy)phenyl]-3-oxidanyl-butanenitrile Openeye Name: 3-hydroxy-2-(3-isobutoxyphenyl)-4-methoxy-butanenitrile CAS Name: 3-hydroxy-4-methoxy-2-[3-(2-methylpropoxy)phenyl]butanenitrile IUPAC Name: 3-hydroxy-4-methoxy-2-[3-(2-methylpropoxy)phenyl]butanenitrile Traditional Name: 3-hydroxy-2-(3-isobutoxyphenyl)-4-methoxy-butyronitrile Formula: C15H21NO3 MolecularWeight: 263.33214

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=CC=CC(=C1)C(C#N)C(COC)O

Isomeric SMILES

CC(C)COC1=CC=CC(=C1)C(C#N)C(COC)O

InChI

InChI=1S/C15H21NO3/c1-11(2)9-19-13-6-4-5-12(7-13)14(8-16)15(17)10-18-3/h4-7,11,14-15,17H,9-10H2,1-3H3