1-[6,7-dimethoxy-1-(4-nitrophenyl)-3,4-dihydro-1H-isoquinolin-2-yl]-2-methoxy-ethanone

Systemtic Name: 1-[6,7-dimethoxy-1-(4-nitrophenyl)-3,4-dihydro-1H-isoquinolin-2-yl]-2-methoxy-ethanone Openeye Name: 1-[6,7-dimethoxy-1-(4-nitrophenyl)-3,4-dihydro-1H-isoquinolin-2-yl]-2-methoxy-ethanone CAS Name: 1-[6,7-dimethoxy-1-(4-nitrophenyl)-3,4-dihydro-1H-isoquinolin-2-yl]-2-methoxyethanone IUPAC Name: 1-[6,7-dimethoxy-1-(4-nitrophenyl)-3,4-dihydro-1H-isoquinolin-2-yl]-2-methoxyethanone Traditional Name: 1-[6,7-dimethoxy-1-(4-nitrophenyl)-3,4-dihydro-1H-isoquinolin-2-yl]-2-methoxy-ethanone Formula: C20H22N2O6 MolecularWeight: 386.39848

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Descriptors Computed from Structure

Canonical SMILES:

COCC(=O)N1CCC2=CC(=C(C=C2C1C3=CC=C(C=C3)[N+](=O)[O-])OC)OC

Isomeric SMILES

COCC(=O)N1CCC2=CC(=C(C=C2C1C3=CC=C(C=C3)[N+](=O)[O-])OC)OC

InChI

InChI=1S/C20H22N2O6/c1-26-12-19(23)21-9-8-14-10-17(27-2)18(28-3)11-16(14)20(21)13-4-6-15(7-5-13)22(24)25/h4-7,10-11,20H,8-9,12H2,1-3H3