methyl 2-[2-(8-fluoranylquinolin-5-yl)sulfonyl-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-1-yl]ethanoate

Systemtic Name: methyl 2-[2-(8-fluoranylquinolin-5-yl)sulfonyl-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-1-yl]ethanoate Openeye Name: methyl 2-[2-[(8-fluoro-5-quinolyl)sulfonyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-1-yl]acetate CAS Name: 2-[2-[(8-fluoro-5-quinolinyl)sulfonyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-1-yl]acetic acid methyl ester IUPAC Name: methyl 2-[2-(8-fluoroquinolin-5-yl)sulfonyl-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-1-yl]acetate Traditional Name: 2-[2-[(8-fluoro-5-quinolyl)sulfonyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-1-yl]acetic acid methyl ester Formula: C23H23FN2O6S MolecularWeight: 474.501923

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(N(CCC2=C1)S(=O)(=O)C3=C4C=CC=NC4=C(C=C3)F)CC(=O)OC)OC

Isomeric SMILES

COC1=C(C=C2C(N(CCC2=C1)S(=O)(=O)C3=C4C=CC=NC4=C(C=C3)F)CC(=O)OC)OC

InChI

InChI=1S/C23H23FN2O6S/c1-30-19-11-14-8-10-26(18(13-22(27)32-3)16(14)12-20(19)31-2)33(28,29)21-7-6-17(24)23-15(21)5-4-9-25-23/h4-7,9,11-12,18H,8,10,13H2,1-3H3