1-[1-(2-chlorophenyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]-3,5,5-trimethyl-hexan-1-one

Systemtic Name: 1-[1-(2-chlorophenyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]-3,5,5-trimethyl-hexan-1-one Openeye Name: 1-[1-(2-chlorophenyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]-3,5,5-trimethyl-hexan-1-one CAS Name: 1-[1-(2-chlorophenyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]-3,5,5-trimethyl-1-hexanone IUPAC Name: 1-[1-(2-chlorophenyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]-3,5,5-trimethylhexan-1-one Traditional Name: 1-[1-(2-chlorophenyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]-3,5,5-trimethyl-hexan-1-one Formula: C26H34ClNO3 MolecularWeight: 444.00606

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)N1CCC2=CC(=C(C=C2C1C3=CC=CC=C3Cl)OC)OC)CC(C)(C)C

Isomeric SMILES

CC(CC(=O)N1CCC2=CC(=C(C=C2C1C3=CC=CC=C3Cl)OC)OC)CC(C)(C)C

InChI

InChI=1S/C26H34ClNO3/c1-17(16-26(2,3)4)13-24(29)28-12-11-18-14-22(30-5)23(31-6)15-20(18)25(28)19-9-7-8-10-21(19)27/h7-10,14-15,17,25H,11-13,16H2,1-6H3