methyl 2-chloranyl-2-[2-ethanoylsulfanyl-4-oxidanylidene-3-(2-phenoxyethanoylamino)azetidin-1-yl]ethanoate

Systemtic Name: methyl 2-chloranyl-2-[2-ethanoylsulfanyl-4-oxidanylidene-3-(2-phenoxyethanoylamino)azetidin-1-yl]ethanoate Openeye Name: methyl 2-[2-acetylsulfanyl-4-oxo-3-[(2-phenoxyacetyl)amino]azetidin-1-yl]-2-chloro-acetate CAS Name: 2-[2-(acetylthio)-4-oxo-3-[(1-oxo-2-phenoxyethyl)amino]-1-azetidinyl]-2-chloroacetic acid methyl ester IUPAC Name: methyl 2-[2-acetylsulfanyl-4-oxo-3-[(2-phenoxyacetyl)amino]azetidin-1-yl]-2-chloroacetate Traditional Name: 2-[2-(acetylthio)-4-keto-3-[(2-phenoxyacetyl)amino]azetidin-1-yl]-2-chloro-acetic acid methyl ester Formula: C16H17ClN2O6S MolecularWeight: 400.83398

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SC1C(C(=O)N1C(C(=O)OC)Cl)NC(=O)COC2=CC=CC=C2

Isomeric SMILES

CC(=O)SC1C(C(=O)N1C(C(=O)OC)Cl)NC(=O)COC2=CC=CC=C2

InChI

InChI=1S/C16H17ClN2O6S/c1-9(20)26-15-12(14(22)19(15)13(17)16(23)24-2)18-11(21)8-25-10-6-4-3-5-7-10/h3-7,12-13,15H,8H2,1-2H3,(H,18,21)