2-[2-[3-azanyl-2-[(4-methylphenyl)sulfonyloxymethyl]-4-oxidanylidene-azetidin-1-yl]sulfanylethanoyloxy]ethanoic acid

Systemtic Name: 2-[2-[3-azanyl-2-[(4-methylphenyl)sulfonyloxymethyl]-4-oxidanylidene-azetidin-1-yl]sulfanylethanoyloxy]ethanoic acid Openeye Name: 2-[2-[3-amino-2-oxo-4-(p-tolylsulfonyloxymethyl)azetidin-1-yl]sulfanylacetyl]oxyacetic acid CAS Name: 2-[2-[[3-amino-2-[(4-methylphenyl)sulfonyloxymethyl]-4-oxo-1-azetidinyl]thio]-1-oxoethoxy]acetic acid IUPAC Name: 2-[2-[3-amino-2-[(4-methylphenyl)sulfonyloxymethyl]-4-oxoazetidin-1-yl]sulfanylacetyl]oxyacetic acid Traditional Name: 2-[2-[[3-amino-2-keto-4-(tosyloxymethyl)azetidin-1-yl]thio]acetyl]oxyacetic acid Formula: C15H18N2O8S2 MolecularWeight: 418.44202

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCC2C(C(=O)N2SCC(=O)OCC(=O)O)N

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCC2C(C(=O)N2SCC(=O)OCC(=O)O)N

InChI

InChI=1S/C15H18N2O8S2/c1-9-2-4-10(5-3-9)27(22,23)25-6-11-14(16)15(21)17(11)26-8-13(20)24-7-12(18)19/h2-5,11,14H,6-8,16H2,1H3,(H,18,19)