aziridin-2-one; 2-[(2-oxidanylidenecyclopent-3-en-1-yl)methylsulfanyl]propanoic acid

Systemtic Name: aziridin-2-one; 2-[(2-oxidanylidenecyclopent-3-en-1-yl)methylsulfanyl]propanoic acid Openeye Name: aziridin-2-one; 2-[(2-oxocyclopent-3-en-1-yl)methylsulfanyl]propanoic acid CAS Name: 2-aziridinone; 2-[(2-oxo-1-cyclopent-3-enyl)methylthio]propanoic acid IUPAC Name: aziridin-2-one; 2-[(2-oxocyclopent-3-en-1-yl)methylsulfanyl]propanoic acid Traditional Name: ethylenimin-2-one; 2-[(2-ketocyclopent-3-en-1-yl)methylthio]propionic acid Formula: C11H15NO4S MolecularWeight: 257.3061

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H12O3S.C2H3NO/c1-6(9(11)12)13-5-7-3-2-4-8(7)10;4-2-1-3-2/h2,4,6-7H,3,5H2,1H3,(H,11,12);1H2,(H,3,4)