methyl (3R)-2-[2-(5-chloranylquinolin-8-yl)oxyethanoyl]-3,4-dihydro-1H-isoquinoline-3-carboxylate

Systemtic Name: methyl (3R)-2-[2-(5-chloranylquinolin-8-yl)oxyethanoyl]-3,4-dihydro-1H-isoquinoline-3-carboxylate Openeye Name: methyl (3R)-2-[2-[(5-chloro-8-quinolyl)oxy]acetyl]-3,4-dihydro-1H-isoquinoline-3-carboxylate CAS Name: (3R)-2-[2-[(5-chloro-8-quinolinyl)oxy]-1-oxoethyl]-3,4-dihydro-1H-isoquinoline-3-carboxylic acid methyl ester IUPAC Name: methyl (3R)-2-[2-(5-chloroquinolin-8-yl)oxyacetyl]-3,4-dihydro-1H-isoquinoline-3-carboxylate Traditional Name: (3R)-2-[2-[(5-chloro-8-quinolyl)oxy]acetyl]-3,4-dihydro-1H-isoquinoline-3-carboxylic acid methyl ester Formula: C22H19ClN2O4 MolecularWeight: 410.85026

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CC2=CC=CC=C2CN1C(=O)COC3=C4C(=C(C=C3)Cl)C=CC=N4

Isomeric SMILES

COC(=O)[C@H]1CC2=CC=CC=C2CN1C(=O)COC3=C4C(=C(C=C3)Cl)C=CC=N4

InChI

InChI=1S/C22H19ClN2O4/c1-28-22(27)18-11-14-5-2-3-6-15(14)12-25(18)20(26)13-29-19-9-8-17(23)16-7-4-10-24-21(16)19/h2-10,18H,11-13H2,1H3/t18-/m1/s1