methyl (2R)-4-[2-[2-(6-methyl-1-benzofuran-3-yl)ethanoyloxy]ethanoyl]thiomorpholine-2-carboxylate

Systemtic Name: methyl (2R)-4-[2-[2-(6-methyl-1-benzofuran-3-yl)ethanoyloxy]ethanoyl]thiomorpholine-2-carboxylate Openeye Name: methyl (2R)-4-[2-[2-(6-methylbenzofuran-3-yl)acetyl]oxyacetyl]thiomorpholine-2-carboxylate CAS Name: (2R)-4-[2-[2-(6-methyl-3-benzofuranyl)-1-oxoethoxy]-1-oxoethyl]-2-thiomorpholinecarboxylic acid methyl ester IUPAC Name: methyl (2R)-4-[2-[2-(6-methyl-1-benzofuran-3-yl)acetyl]oxyacetyl]thiomorpholine-2-carboxylate Traditional Name: (2R)-4-[2-[2-(6-methylbenzofuran-3-yl)acetyl]oxyacetyl]thiomorpholine-2-carboxylic acid methyl ester Formula: C19H21NO6S MolecularWeight: 391.43814

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=CO2)CC(=O)OCC(=O)N3CCSC(C3)C(=O)OC

Isomeric SMILES

CC1=CC2=C(C=C1)C(=CO2)CC(=O)OCC(=O)N3CCS[C@H](C3)C(=O)OC

InChI

InChI=1S/C19H21NO6S/c1-12-3-4-14-13(10-25-15(14)7-12)8-18(22)26-11-17(21)20-5-6-27-16(9-20)19(23)24-2/h3-4,7,10,16H,5-6,8-9,11H2,1-2H3/t16-/m1/s1