2-(2-bromanyl-4,5-dimethoxy-phenyl)-1-[6,7-dimethoxy-1-(3-nitrophenyl)-3,4-dihydro-1H-isoquinolin-2-yl]ethanone

Systemtic Name: 2-(2-bromanyl-4,5-dimethoxy-phenyl)-1-[6,7-dimethoxy-1-(3-nitrophenyl)-3,4-dihydro-1H-isoquinolin-2-yl]ethanone Openeye Name: 2-(2-bromo-4,5-dimethoxy-phenyl)-1-[6,7-dimethoxy-1-(3-nitrophenyl)-3,4-dihydro-1H-isoquinolin-2-yl]ethanone CAS Name: 2-(2-bromo-4,5-dimethoxyphenyl)-1-[6,7-dimethoxy-1-(3-nitrophenyl)-3,4-dihydro-1H-isoquinolin-2-yl]ethanone IUPAC Name: 2-(2-bromo-4,5-dimethoxyphenyl)-1-[6,7-dimethoxy-1-(3-nitrophenyl)-3,4-dihydro-1H-isoquinolin-2-yl]ethanone Traditional Name: 2-(2-bromo-4,5-dimethoxy-phenyl)-1-[6,7-dimethoxy-1-(3-nitrophenyl)-3,4-dihydro-1H-isoquinolin-2-yl]ethanone Formula: C27H27BrN2O7 MolecularWeight: 571.41648

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(N(CCC2=C1)C(=O)CC3=CC(=C(C=C3Br)OC)OC)C4=CC(=CC=C4)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C2C(N(CCC2=C1)C(=O)CC3=CC(=C(C=C3Br)OC)OC)C4=CC(=CC=C4)[N+](=O)[O-])OC

InChI

InChI=1S/C27H27BrN2O7/c1-34-22-11-16-8-9-29(26(31)13-18-12-23(35-2)25(37-4)15-21(18)28)27(20(16)14-24(22)36-3)17-6-5-7-19(10-17)30(32)33/h5-7,10-12,14-15,27H,8-9,13H2,1-4H3