methyl 2-(1-acetamidoethylsulfanyl)-2-methyl-3-oxidanylidene-cyclopentane-1-carboxylate

Systemtic Name: methyl 2-(1-acetamidoethylsulfanyl)-2-methyl-3-oxidanylidene-cyclopentane-1-carboxylate Openeye Name: methyl 2-(1-acetamidoethylsulfanyl)-2-methyl-3-oxo-cyclopentanecarboxylate CAS Name: 2-(1-acetamidoethylthio)-2-methyl-3-oxo-1-cyclopentanecarboxylic acid methyl ester IUPAC Name: methyl 2-(1-acetamidoethylsulfanyl)-2-methyl-3-oxocyclopentane-1-carboxylate Traditional Name: 2-(1-acetamidoethylthio)-3-keto-2-methyl-cyclopentanecarboxylic acid methyl ester Formula: C12H19NO4S MolecularWeight: 273.34856

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Descriptors Computed from Structure

Canonical SMILES:

CC(NC(=O)C)SC1(C(CCC1=O)C(=O)OC)C

Isomeric SMILES

CC(NC(=O)C)SC1(C(CCC1=O)C(=O)OC)C

InChI

InChI=1S/C12H19NO4S/c1-7(14)13-8(2)18-12(3)9(11(16)17-4)5-6-10(12)15/h8-9H,5-6H2,1-4H3,(H,13,14)