2-(1-acetamidoethylsulfanyl)-3-methyl-4-oxidanylidene-cyclopent-2-ene-1-carboxylic acid

Systemtic Name: 2-(1-acetamidoethylsulfanyl)-3-methyl-4-oxidanylidene-cyclopent-2-ene-1-carboxylic acid Openeye Name: 2-(1-acetamidoethylsulfanyl)-3-methyl-4-oxo-cyclopent-2-ene-1-carboxylic acid CAS Name: 2-(1-acetamidoethylthio)-3-methyl-4-oxo-1-cyclopent-2-enecarboxylic acid IUPAC Name: 2-(1-acetamidoethylsulfanyl)-3-methyl-4-oxocyclopent-2-ene-1-carboxylic acid Traditional Name: 2-(1-acetamidoethylthio)-4-keto-3-methyl-cyclopent-2-ene-1-carboxylic acid Formula: C11H15NO4S MolecularWeight: 257.3061

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(CC1=O)C(=O)O)SC(C)NC(=O)C

Isomeric SMILES

CC1=C(C(CC1=O)C(=O)O)SC(C)NC(=O)C

InChI

InChI=1S/C11H15NO4S/c1-5-9(14)4-8(11(15)16)10(5)17-7(3)12-6(2)13/h7-8H,4H2,1-3H3,(H,12,13)(H,15,16)