2-[1-(diethylamino)propan-2-yl]-6,7-dimethoxy-1-(2-methylphenyl)-1H-isoquinoline-4-carboxylic acid

Systemtic Name: 2-[1-(diethylamino)propan-2-yl]-6,7-dimethoxy-1-(2-methylphenyl)-1H-isoquinoline-4-carboxylic acid Openeye Name: 2-[2-(diethylamino)-1-methyl-ethyl]-6,7-dimethoxy-1-(o-tolyl)-1H-isoquinoline-4-carboxylic acid CAS Name: 2-[1-(diethylamino)propan-2-yl]-6,7-dimethoxy-1-(2-methylphenyl)-1H-isoquinoline-4-carboxylic acid IUPAC Name: 2-[1-(diethylamino)propan-2-yl]-6,7-dimethoxy-1-(2-methylphenyl)-1H-isoquinoline-4-carboxylic acid Traditional Name: 2-[2-(diethylamino)-1-methyl-ethyl]-6,7-dimethoxy-1-(o-tolyl)-1H-isoquinoline-4-carboxylic acid Formula: C26H34N2O4 MolecularWeight: 438.55916

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC(C)N1C=C(C2=CC(=C(C=C2C1C3=CC=CC=C3C)OC)OC)C(=O)O

Isomeric SMILES

CCN(CC)CC(C)N1C=C(C2=CC(=C(C=C2C1C3=CC=CC=C3C)OC)OC)C(=O)O

InChI

InChI=1S/C26H34N2O4/c1-7-27(8-2)15-18(4)28-16-22(26(29)30)20-13-23(31-5)24(32-6)14-21(20)25(28)19-12-10-9-11-17(19)3/h9-14,16,18,25H,7-8,15H2,1-6H3,(H,29,30)