2-[2-[2-(chloromethyl)-3-(2-cyanoethanoylamino)-4-oxidanylidene-azetidin-1-yl]sulfanylethanoyloxy]ethanoic acid

Systemtic Name: 2-[2-[2-(chloromethyl)-3-(2-cyanoethanoylamino)-4-oxidanylidene-azetidin-1-yl]sulfanylethanoyloxy]ethanoic acid Openeye Name: 2-[2-[2-(chloromethyl)-3-[(2-cyanoacetyl)amino]-4-oxo-azetidin-1-yl]sulfanylacetyl]oxyacetic acid CAS Name: 2-[2-[[2-(chloromethyl)-3-[(2-cyano-1-oxoethyl)amino]-4-oxo-1-azetidinyl]thio]-1-oxoethoxy]acetic acid IUPAC Name: 2-[2-[2-(chloromethyl)-3-[(2-cyanoacetyl)amino]-4-oxoazetidin-1-yl]sulfanylacetyl]oxyacetic acid Traditional Name: 2-[2-[[2-(chloromethyl)-3-[(2-cyanoacetyl)amino]-4-keto-azetidin-1-yl]thio]acetyl]oxyacetic acid Formula: C11H12ClN3O6S MolecularWeight: 349.74748

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Descriptors Computed from Structure

Canonical SMILES:

C(C#N)C(=O)NC1C(N(C1=O)SCC(=O)OCC(=O)O)CCl

Isomeric SMILES

C(C#N)C(=O)NC1C(N(C1=O)SCC(=O)OCC(=O)O)CCl

InChI

InChI=1S/C11H12ClN3O6S/c12-3-6-10(14-7(16)1-2-13)11(20)15(6)22-5-9(19)21-4-8(17)18/h6,10H,1,3-5H2,(H,14,16)(H,17,18)