4-bromanyl-1-(3-ethanoylsulfanyl-2-methyl-propanoyl)pyrrolidine-2-carboxylic acid

Systemtic Name: 4-bromanyl-1-(3-ethanoylsulfanyl-2-methyl-propanoyl)pyrrolidine-2-carboxylic acid Openeye Name: 1-(3-acetylsulfanyl-2-methyl-propanoyl)-4-bromo-pyrrolidine-2-carboxylic acid CAS Name: 1-[3-(acetylthio)-2-methyl-1-oxopropyl]-4-bromo-2-pyrrolidinecarboxylic acid IUPAC Name: 1-(3-acetylsulfanyl-2-methylpropanoyl)-4-bromopyrrolidine-2-carboxylic acid Traditional Name: 1-[3-(acetylthio)-2-methyl-propanoyl]-4-bromo-proline Formula: C11H16BrNO4S MolecularWeight: 338.21804

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Descriptors Computed from Structure

Canonical SMILES:

CC(CSC(=O)C)C(=O)N1CC(CC1C(=O)O)Br

Isomeric SMILES

CC(CSC(=O)C)C(=O)N1CC(CC1C(=O)O)Br

InChI

InChI=1S/C11H16BrNO4S/c1-6(5-18-7(2)14)10(15)13-4-8(12)3-9(13)11(16)17/h6,8-9H,3-5H2,1-2H3,(H,16,17)