2-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)-5,5-dimethyl-cyclohexane-1,3-dione

Systemtic Name: 2-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)-5,5-dimethyl-cyclohexane-1,3-dione Openeye Name: 2-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)-5,5-dimethyl-cyclohexane-1,3-dione CAS Name: 2-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)-5,5-dimethylcyclohexane-1,3-dione IUPAC Name: 2-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)-5,5-dimethylcyclohexane-1,3-dione Traditional Name: 2-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)-5,5-dimethyl-cyclohexane-1,3-quinone Formula: C19H25NO4 MolecularWeight: 331.4061

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=O)C(C(=O)C1)C2C3=CC(=C(C=C3CCN2)OC)OC)C

Isomeric SMILES

CC1(CC(=O)C(C(=O)C1)C2C3=CC(=C(C=C3CCN2)OC)OC)C

InChI

InChI=1S/C19H25NO4/c1-19(2)9-13(21)17(14(22)10-19)18-12-8-16(24-4)15(23-3)7-11(12)5-6-20-18/h7-8,17-18,20H,5-6,9-10H2,1-4H3