aziridin-2-one; 3-[(1-methoxy-1-oxidanylidene-propan-2-yl)sulfanylmethyl]-4-oxidanylidene-cyclopentane-1-carboxylic acid

Systemtic Name: aziridin-2-one; 3-[(1-methoxy-1-oxidanylidene-propan-2-yl)sulfanylmethyl]-4-oxidanylidene-cyclopentane-1-carboxylic acid Openeye Name: aziridin-2-one; 3-[(2-methoxy-1-methyl-2-oxo-ethyl)sulfanylmethyl]-4-oxo-cyclopentanecarboxylic acid CAS Name: 2-aziridinone; 3-[[(1-methoxy-1-oxopropan-2-yl)thio]methyl]-4-oxo-1-cyclopentanecarboxylic acid IUPAC Name: aziridin-2-one; 3-[(1-methoxy-1-oxopropan-2-yl)sulfanylmethyl]-4-oxocyclopentane-1-carboxylic acid Traditional Name: ethylenimin-2-one; 3-keto-4-[[(2-keto-2-methoxy-1-methyl-ethyl)thio]methyl]cyclopentanecarboxylic acid Formula: C13H19NO6S MolecularWeight: 317.35806

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OC)SCC1CC(CC1=O)C(=O)O.C1C(=O)N1

Isomeric SMILES

CC(C(=O)OC)SCC1CC(CC1=O)C(=O)O.C1C(=O)N1

InChI

InChI=1S/C11H16O5S.C2H3NO/c1-6(11(15)16-2)17-5-8-3-7(10(13)14)4-9(8)12;4-2-1-3-2/h6-8H,3-5H2,1-2H3,(H,13,14);1H2,(H,3,4)