[6-(2-methylpropoxy)-3,4-dihydroisoquinolin-1-yl]-phenyl-methanone

Systemtic Name: [6-(2-methylpropoxy)-3,4-dihydroisoquinolin-1-yl]-phenyl-methanone Openeye Name: (6-isobutoxy-3,4-dihydroisoquinolin-1-yl)-phenyl-methanone CAS Name: [6-(2-methylpropoxy)-3,4-dihydroisoquinolin-1-yl]-phenylmethanone IUPAC Name: [6-(2-methylpropoxy)-3,4-dihydroisoquinolin-1-yl]-phenylmethanone Traditional Name: (6-isobutoxy-3,4-dihydroisoquinolin-1-yl)-phenyl-methanone Formula: C20H21NO2 MolecularWeight: 307.38624

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=CC2=C(C=C1)C(=NCC2)C(=O)C3=CC=CC=C3

Isomeric SMILES

CC(C)COC1=CC2=C(C=C1)C(=NCC2)C(=O)C3=CC=CC=C3

InChI

InChI=1S/C20H21NO2/c1-14(2)13-23-17-8-9-18-16(12-17)10-11-21-19(18)20(22)15-6-4-3-5-7-15/h3-9,12,14H,10-11,13H2,1-2H3