methyl (2S)-4-[2-[(2-oxidanylidene-1H-quinolin-4-yl)carbonyloxy]ethanoyl]thiomorpholine-2-carboxylate

Systemtic Name: methyl (2S)-4-[2-[(2-oxidanylidene-1H-quinolin-4-yl)carbonyloxy]ethanoyl]thiomorpholine-2-carboxylate Openeye Name: methyl (2S)-4-[2-(2-oxo-1H-quinoline-4-carbonyl)oxyacetyl]thiomorpholine-2-carboxylate CAS Name: (2S)-4-[1-oxo-2-[oxo-(2-oxo-1H-quinolin-4-yl)methoxy]ethyl]-2-thiomorpholinecarboxylic acid methyl ester IUPAC Name: methyl (2S)-4-[2-(2-oxo-1H-quinoline-4-carbonyl)oxyacetyl]thiomorpholine-2-carboxylate Traditional Name: (2S)-4-[2-(2-keto-1H-quinoline-4-carbonyl)oxyacetyl]thiomorpholine-2-carboxylic acid methyl ester Formula: C18H18N2O6S MolecularWeight: 390.41032

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CN(CCS1)C(=O)COC(=O)C2=CC(=O)NC3=CC=CC=C32

Isomeric SMILES

COC(=O)[C@@H]1CN(CCS1)C(=O)COC(=O)C2=CC(=O)NC3=CC=CC=C32

InChI

InChI=1S/C18H18N2O6S/c1-25-18(24)14-9-20(6-7-27-14)16(22)10-26-17(23)12-8-15(21)19-13-5-3-2-4-11(12)13/h2-5,8,14H,6-7,9-10H2,1H3,(H,19,21)/t14-/m0/s1