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

Systemtic Name: 3-chloranyl-1-(3-ethanoylsulfanyl-2-methyl-propanoyl)pyrrolidine-2-carboxylic acid Openeye Name: 1-(3-acetylsulfanyl-2-methyl-propanoyl)-3-chloro-pyrrolidine-2-carboxylic acid CAS Name: 1-[3-(acetylthio)-2-methyl-1-oxopropyl]-3-chloro-2-pyrrolidinecarboxylic acid IUPAC Name: 1-(3-acetylsulfanyl-2-methylpropanoyl)-3-chloropyrrolidine-2-carboxylic acid Traditional Name: 1-[3-(acetylthio)-2-methyl-propanoyl]-3-chloro-proline Formula: C11H16ClNO4S MolecularWeight: 293.76704

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Descriptors Computed from Structure

Canonical SMILES:

CC(CSC(=O)C)C(=O)N1CCC(C1C(=O)O)Cl

Isomeric SMILES

CC(CSC(=O)C)C(=O)N1CCC(C1C(=O)O)Cl

InChI

InChI=1S/C11H16ClNO4S/c1-6(5-18-7(2)14)10(15)13-4-3-8(12)9(13)11(16)17/h6,8-9H,3-5H2,1-2H3,(H,16,17)