methyl (2R)-4-[2-(2-ethyl-3-methyl-quinolin-4-yl)carbonyloxyethanoyl]thiomorpholine-2-carboxylate

Systemtic Name: methyl (2R)-4-[2-(2-ethyl-3-methyl-quinolin-4-yl)carbonyloxyethanoyl]thiomorpholine-2-carboxylate Openeye Name: methyl (2R)-4-[2-(2-ethyl-3-methyl-quinoline-4-carbonyl)oxyacetyl]thiomorpholine-2-carboxylate CAS Name: (2R)-4-[2-[(2-ethyl-3-methyl-4-quinolinyl)-oxomethoxy]-1-oxoethyl]-2-thiomorpholinecarboxylic acid methyl ester IUPAC Name: methyl (2R)-4-[2-(2-ethyl-3-methylquinoline-4-carbonyl)oxyacetyl]thiomorpholine-2-carboxylate Traditional Name: (2R)-4-[2-(2-ethyl-3-methyl-quinoline-4-carbonyl)oxyacetyl]thiomorpholine-2-carboxylic acid methyl ester Formula: C21H24N2O5S MolecularWeight: 416.49066

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=CC=CC=C2C(=C1C)C(=O)OCC(=O)N3CCSC(C3)C(=O)OC

Isomeric SMILES

CCC1=NC2=CC=CC=C2C(=C1C)C(=O)OCC(=O)N3CCS[C@H](C3)C(=O)OC

InChI

InChI=1S/C21H24N2O5S/c1-4-15-13(2)19(14-7-5-6-8-16(14)22-15)21(26)28-12-18(24)23-9-10-29-17(11-23)20(25)27-3/h5-8,17H,4,9-12H2,1-3H3/t17-/m1/s1