methyl 2-[6,7-dimethoxy-2-(4-methoxy-3-nitro-phenyl)carbonyl-3,4-dihydro-1H-isoquinolin-1-yl]ethanoate

Systemtic Name: methyl 2-[6,7-dimethoxy-2-(4-methoxy-3-nitro-phenyl)carbonyl-3,4-dihydro-1H-isoquinolin-1-yl]ethanoate Openeye Name: methyl 2-[6,7-dimethoxy-2-(4-methoxy-3-nitro-benzoyl)-3,4-dihydro-1H-isoquinolin-1-yl]acetate CAS Name: 2-[6,7-dimethoxy-2-[(4-methoxy-3-nitrophenyl)-oxomethyl]-3,4-dihydro-1H-isoquinolin-1-yl]acetic acid methyl ester IUPAC Name: methyl 2-[6,7-dimethoxy-2-(4-methoxy-3-nitrobenzoyl)-3,4-dihydro-1H-isoquinolin-1-yl]acetate Traditional Name: 2-[6,7-dimethoxy-2-(4-methoxy-3-nitro-benzoyl)-3,4-dihydro-1H-isoquinolin-1-yl]acetic acid methyl ester Formula: C22H24N2O8 MolecularWeight: 444.43456

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)N2CCC3=CC(=C(C=C3C2CC(=O)OC)OC)OC)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)N2CCC3=CC(=C(C=C3C2CC(=O)OC)OC)OC)[N+](=O)[O-]

InChI

InChI=1S/C22H24N2O8/c1-29-18-6-5-14(9-17(18)24(27)28)22(26)23-8-7-13-10-19(30-2)20(31-3)11-15(13)16(23)12-21(25)32-4/h5-6,9-11,16H,7-8,12H2,1-4H3