1-(2-bromanylethanoyl)-4-phenylsulfanyl-pyrrolidine-2-carboxylic acid

Systemtic Name: 1-(2-bromanylethanoyl)-4-phenylsulfanyl-pyrrolidine-2-carboxylic acid Openeye Name: 1-(2-bromoacetyl)-4-phenylsulfanyl-pyrrolidine-2-carboxylic acid CAS Name: 1-(2-bromo-1-oxoethyl)-4-(phenylthio)-2-pyrrolidinecarboxylic acid IUPAC Name: 1-(2-bromoacetyl)-4-phenylsulfanylpyrrolidine-2-carboxylic acid Traditional Name: 1-(2-bromoacetyl)-4-(phenylthio)proline Formula: C13H14BrNO3S MolecularWeight: 344.22416

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CN(C1C(=O)O)C(=O)CBr)SC2=CC=CC=C2

Isomeric SMILES

C1C(CN(C1C(=O)O)C(=O)CBr)SC2=CC=CC=C2

InChI

InChI=1S/C13H14BrNO3S/c14-7-12(16)15-8-10(6-11(15)13(17)18)19-9-4-2-1-3-5-9/h1-5,10-11H,6-8H2,(H,17,18)