2-[4-methoxy-3-(4-oxidanyl-2,3-dihydro-1H-isoquinolin-4-yl)phenyl]-2-methyl-propanenitrile

Systemtic Name: 2-[4-methoxy-3-(4-oxidanyl-2,3-dihydro-1H-isoquinolin-4-yl)phenyl]-2-methyl-propanenitrile Openeye Name: 2-[3-(4-hydroxy-2,3-dihydro-1H-isoquinolin-4-yl)-4-methoxy-phenyl]-2-methyl-propanenitrile CAS Name: 2-[3-(4-hydroxy-2,3-dihydro-1H-isoquinolin-4-yl)-4-methoxyphenyl]-2-methylpropanenitrile IUPAC Name: 2-[3-(4-hydroxy-2,3-dihydro-1H-isoquinolin-4-yl)-4-methoxyphenyl]-2-methylpropanenitrile Traditional Name: 2-[3-(4-hydroxy-2,3-dihydro-1H-isoquinolin-4-yl)-4-methoxy-phenyl]-2-methyl-propionitrile Formula: C20H22N2O2 MolecularWeight: 322.40088

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C#N)C1=CC(=C(C=C1)OC)C2(CNCC3=CC=CC=C32)O

Isomeric SMILES

CC(C)(C#N)C1=CC(=C(C=C1)OC)C2(CNCC3=CC=CC=C32)O

InChI

InChI=1S/C20H22N2O2/c1-19(2,12-21)15-8-9-18(24-3)17(10-15)20(23)13-22-11-14-6-4-5-7-16(14)20/h4-10,22-23H,11,13H2,1-3H3