[2-(2-acetamidoethylsulfanylmethyl)-3-oxidanylidene-cyclopentyl]methyl ethanoate

Systemtic Name: [2-(2-acetamidoethylsulfanylmethyl)-3-oxidanylidene-cyclopentyl]methyl ethanoate Openeye Name: [2-(2-acetamidoethylsulfanylmethyl)-3-oxo-cyclopentyl]methyl acetate CAS Name: acetic acid [2-[(2-acetamidoethylthio)methyl]-3-oxocyclopentyl]methyl ester IUPAC Name: [2-(2-acetamidoethylsulfanylmethyl)-3-oxocyclopentyl]methyl acetate Traditional Name: acetic acid [2-[(2-acetamidoethylthio)methyl]-3-keto-cyclopentyl]methyl ester Formula: C13H21NO4S MolecularWeight: 287.37514

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCCSCC1C(CCC1=O)COC(=O)C

Isomeric SMILES

CC(=O)NCCSCC1C(CCC1=O)COC(=O)C

InChI

InChI=1S/C13H21NO4S/c1-9(15)14-5-6-19-8-12-11(3-4-13(12)17)7-18-10(2)16/h11-12H,3-8H2,1-2H3,(H,14,15)