methyl 2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-5-nitro-benzoate

Systemtic Name: methyl 2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-5-nitro-benzoate Openeye Name: methyl 2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-5-nitro-benzoate CAS Name: 2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-5-nitrobenzoic acid methyl ester IUPAC Name: methyl 2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-5-nitrobenzoate Traditional Name: 2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-5-nitro-benzoic acid methyl ester Formula: C19H20N2O6 MolecularWeight: 372.3719

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2CN(CCC2=C1)C3=C(C=C(C=C3)[N+](=O)[O-])C(=O)OC)OC

Isomeric SMILES

COC1=C(C=C2CN(CCC2=C1)C3=C(C=C(C=C3)[N+](=O)[O-])C(=O)OC)OC

InChI

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