1-[1-(3,4-dimethoxyphenyl)-7-nitro-3,4-dihydro-1H-isoquinolin-2-yl]ethanone

Systemtic Name: 1-[1-(3,4-dimethoxyphenyl)-7-nitro-3,4-dihydro-1H-isoquinolin-2-yl]ethanone Openeye Name: 1-[1-(3,4-dimethoxyphenyl)-7-nitro-3,4-dihydro-1H-isoquinolin-2-yl]ethanone CAS Name: 1-[1-(3,4-dimethoxyphenyl)-7-nitro-3,4-dihydro-1H-isoquinolin-2-yl]ethanone IUPAC Name: 1-[1-(3,4-dimethoxyphenyl)-7-nitro-3,4-dihydro-1H-isoquinolin-2-yl]ethanone Traditional Name: 1-[1-(3,4-dimethoxyphenyl)-7-nitro-3,4-dihydro-1H-isoquinolin-2-yl]ethanone Formula: C19H20N2O5 MolecularWeight: 356.3725

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCC2=C(C1C3=CC(=C(C=C3)OC)OC)C=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC(=O)N1CCC2=C(C1C3=CC(=C(C=C3)OC)OC)C=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C19H20N2O5/c1-12(22)20-9-8-13-4-6-15(21(23)24)11-16(13)19(20)14-5-7-17(25-2)18(10-14)26-3/h4-7,10-11,19H,8-9H2,1-3H3