methyl 2-[(1R)-6,7-dimethoxy-2-(2-nitrophenyl)-3,4-dihydro-1H-isoquinolin-1-yl]ethanoate

Systemtic Name: methyl 2-[(1R)-6,7-dimethoxy-2-(2-nitrophenyl)-3,4-dihydro-1H-isoquinolin-1-yl]ethanoate Openeye Name: methyl 2-[(1R)-6,7-dimethoxy-2-(2-nitrophenyl)-3,4-dihydro-1H-isoquinolin-1-yl]acetate CAS Name: 2-[(1R)-6,7-dimethoxy-2-(2-nitrophenyl)-3,4-dihydro-1H-isoquinolin-1-yl]acetic acid methyl ester IUPAC Name: methyl 2-[(1R)-6,7-dimethoxy-2-(2-nitrophenyl)-3,4-dihydro-1H-isoquinolin-1-yl]acetate Traditional Name: 2-[(1R)-6,7-dimethoxy-2-(2-nitrophenyl)-3,4-dihydro-1H-isoquinolin-1-yl]acetic acid methyl ester Formula: C20H22N2O6 MolecularWeight: 386.39848

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(N(CCC2=C1)C3=CC=CC=C3[N+](=O)[O-])CC(=O)OC)OC

Isomeric SMILES

COC1=C(C=C2[C@H](N(CCC2=C1)C3=CC=CC=C3[N+](=O)[O-])CC(=O)OC)OC

InChI

InChI=1S/C20H22N2O6/c1-26-18-10-13-8-9-21(15-6-4-5-7-16(15)22(24)25)17(12-20(23)28-3)14(13)11-19(18)27-2/h4-7,10-11,17H,8-9,12H2,1-3H3/t17-/m1/s1