methyl (3R)-2-[2-[(6-oxidanylidene-4,5-dihydro-1H-pyridazin-3-yl)carbonyloxy]ethanoyl]-3,4-dihydro-1H-isoquinoline-3-carboxylate

Systemtic Name: methyl (3R)-2-[2-[(6-oxidanylidene-4,5-dihydro-1H-pyridazin-3-yl)carbonyloxy]ethanoyl]-3,4-dihydro-1H-isoquinoline-3-carboxylate Openeye Name: methyl (3R)-2-[2-(6-oxo-4,5-dihydro-1H-pyridazine-3-carbonyl)oxyacetyl]-3,4-dihydro-1H-isoquinoline-3-carboxylate CAS Name: (3R)-2-[1-oxo-2-[oxo-(6-oxo-4,5-dihydro-1H-pyridazin-3-yl)methoxy]ethyl]-3,4-dihydro-1H-isoquinoline-3-carboxylic acid methyl ester IUPAC Name: methyl (3R)-2-[2-(6-oxo-4,5-dihydro-1H-pyridazine-3-carbonyl)oxyacetyl]-3,4-dihydro-1H-isoquinoline-3-carboxylate Traditional Name: (3R)-2-[2-(6-keto-4,5-dihydro-1H-pyridazine-3-carbonyl)oxyacetyl]-3,4-dihydro-1H-isoquinoline-3-carboxylic acid methyl ester Formula: C18H19N3O6 MolecularWeight: 373.35996

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CC2=CC=CC=C2CN1C(=O)COC(=O)C3=NNC(=O)CC3

Isomeric SMILES

COC(=O)[C@H]1CC2=CC=CC=C2CN1C(=O)COC(=O)C3=NNC(=O)CC3

InChI

InChI=1S/C18H19N3O6/c1-26-18(25)14-8-11-4-2-3-5-12(11)9-21(14)16(23)10-27-17(24)13-6-7-15(22)20-19-13/h2-5,14H,6-10H2,1H3,(H,20,22)/t14-/m1/s1