methyl (2R)-4-[3-(2-oxidanylidenepyrrolidin-1-yl)phenyl]carbonylthiomorpholine-2-carboxylate

Systemtic Name: methyl (2R)-4-[3-(2-oxidanylidenepyrrolidin-1-yl)phenyl]carbonylthiomorpholine-2-carboxylate Openeye Name: methyl (2R)-4-[3-(2-oxopyrrolidin-1-yl)benzoyl]thiomorpholine-2-carboxylate CAS Name: (2R)-4-[oxo-[3-(2-oxo-1-pyrrolidinyl)phenyl]methyl]-2-thiomorpholinecarboxylic acid methyl ester IUPAC Name: methyl (2R)-4-[3-(2-oxopyrrolidin-1-yl)benzoyl]thiomorpholine-2-carboxylate Traditional Name: (2R)-4-[3-(2-ketopyrrolidino)benzoyl]thiomorpholine-2-carboxylic acid methyl ester Formula: C17H20N2O4S MolecularWeight: 348.4167

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CN(CCS1)C(=O)C2=CC(=CC=C2)N3CCCC3=O

Isomeric SMILES

COC(=O)[C@H]1CN(CCS1)C(=O)C2=CC(=CC=C2)N3CCCC3=O

InChI

InChI=1S/C17H20N2O4S/c1-23-17(22)14-11-18(8-9-24-14)16(21)12-4-2-5-13(10-12)19-7-3-6-15(19)20/h2,4-5,10,14H,3,6-9,11H2,1H3/t14-/m1/s1