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

Systemtic Name: methyl 2-[(1R)-6,7-dimethoxy-2-(3-nitropyridin-2-yl)-3,4-dihydro-1H-isoquinolin-1-yl]ethanoate Openeye Name: methyl 2-[(1R)-6,7-dimethoxy-2-(3-nitro-2-pyridyl)-3,4-dihydro-1H-isoquinolin-1-yl]acetate CAS Name: 2-[(1R)-6,7-dimethoxy-2-(3-nitro-2-pyridinyl)-3,4-dihydro-1H-isoquinolin-1-yl]acetic acid methyl ester IUPAC Name: methyl 2-[(1R)-6,7-dimethoxy-2-(3-nitropyridin-2-yl)-3,4-dihydro-1H-isoquinolin-1-yl]acetate Traditional Name: 2-[(1R)-6,7-dimethoxy-2-(3-nitro-2-pyridyl)-3,4-dihydro-1H-isoquinolin-1-yl]acetic acid methyl ester Formula: C19H21N3O6 MolecularWeight: 387.38654

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(N(CCC2=C1)C3=C(C=CC=N3)[N+](=O)[O-])CC(=O)OC)OC

Isomeric SMILES

COC1=C(C=C2[C@H](N(CCC2=C1)C3=C(C=CC=N3)[N+](=O)[O-])CC(=O)OC)OC

InChI

InChI=1S/C19H21N3O6/c1-26-16-9-12-6-8-21(19-14(22(24)25)5-4-7-20-19)15(11-18(23)28-3)13(12)10-17(16)27-2/h4-5,7,9-10,15H,6,8,11H2,1-3H3/t15-/m1/s1