methyl (2R)-4-(3-ethanoylphenyl)sulfonylthiomorpholine-2-carboxylate

Systemtic Name: methyl (2R)-4-(3-ethanoylphenyl)sulfonylthiomorpholine-2-carboxylate Openeye Name: methyl (2R)-4-(3-acetylphenyl)sulfonylthiomorpholine-2-carboxylate CAS Name: (2R)-4-(3-acetylphenyl)sulfonyl-2-thiomorpholinecarboxylic acid methyl ester IUPAC Name: methyl (2R)-4-(3-acetylphenyl)sulfonylthiomorpholine-2-carboxylate Traditional Name: (2R)-4-(3-acetylphenyl)sulfonylthiomorpholine-2-carboxylic acid methyl ester Formula: C14H17NO5S2 MolecularWeight: 343.41848

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)S(=O)(=O)N2CCSC(C2)C(=O)OC

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)S(=O)(=O)N2CCS[C@H](C2)C(=O)OC

InChI

InChI=1S/C14H17NO5S2/c1-10(16)11-4-3-5-12(8-11)22(18,19)15-6-7-21-13(9-15)14(17)20-2/h3-5,8,13H,6-7,9H2,1-2H3/t13-/m1/s1