1-[4-(5,8-dimethoxy-4-oxidanyl-3,4-dihydro-1H-isoquinolin-2-yl)-3-nitro-phenyl]ethanone

Systemtic Name: 1-[4-(5,8-dimethoxy-4-oxidanyl-3,4-dihydro-1H-isoquinolin-2-yl)-3-nitro-phenyl]ethanone Openeye Name: 1-[4-(4-hydroxy-5,8-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-3-nitro-phenyl]ethanone CAS Name: 1-[4-(4-hydroxy-5,8-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-3-nitrophenyl]ethanone IUPAC Name: 1-[4-(4-hydroxy-5,8-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-3-nitrophenyl]ethanone Traditional Name: 1-[4-(4-hydroxy-5,8-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-3-nitro-phenyl]ethanone Formula: C19H20N2O6 MolecularWeight: 372.3719

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1)N2CC(C3=C(C=CC(=C3C2)OC)OC)O)[N+](=O)[O-]

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1)N2CC(C3=C(C=CC(=C3C2)OC)OC)O)[N+](=O)[O-]

InChI

InChI=1S/C19H20N2O6/c1-11(22)12-4-5-14(15(8-12)21(24)25)20-9-13-17(26-2)6-7-18(27-3)19(13)16(23)10-20/h4-8,16,23H,9-10H2,1-3H3