methyl (2R)-4-(3-bromophenyl)carbonylthiomorpholine-2-carboxylate

Systemtic Name: methyl (2R)-4-(3-bromophenyl)carbonylthiomorpholine-2-carboxylate Openeye Name: methyl (2R)-4-(3-bromobenzoyl)thiomorpholine-2-carboxylate CAS Name: (2R)-4-[(3-bromophenyl)-oxomethyl]-2-thiomorpholinecarboxylic acid methyl ester IUPAC Name: methyl (2R)-4-(3-bromobenzoyl)thiomorpholine-2-carboxylate Traditional Name: (2R)-4-(3-bromobenzoyl)thiomorpholine-2-carboxylic acid methyl ester Formula: C13H14BrNO3S MolecularWeight: 344.22416

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H14BrNO3S/c1-18-13(17)11-8-15(5-6-19-11)12(16)9-3-2-4-10(14)7-9/h2-4,7,11H,5-6,8H2,1H3/t11-/m1/s1