2,2,2-tris(chloranyl)ethyl 2-(3-acetamido-2-bromanyl-4-oxidanylidene-azetidin-1-yl)-3-bromanylsulfanyl-3-methyl-butanoate

Systemtic Name: 2,2,2-tris(chloranyl)ethyl 2-(3-acetamido-2-bromanyl-4-oxidanylidene-azetidin-1-yl)-3-bromanylsulfanyl-3-methyl-butanoate Openeye Name: 2,2,2-trichloroethyl 2-(3-acetamido-2-bromo-4-oxo-azetidin-1-yl)-3-bromosulfanyl-3-methyl-butanoate CAS Name: 2-(3-acetamido-2-bromo-4-oxo-1-azetidinyl)-3-(bromothio)-3-methylbutanoic acid 2,2,2-trichloroethyl ester IUPAC Name: 2,2,2-trichloroethyl 2-(3-acetamido-2-bromo-4-oxoazetidin-1-yl)-3-bromosulfanyl-3-methylbutanoate Traditional Name: 2-(3-acetamido-2-bromo-4-keto-azetidin-1-yl)-3-(bromothio)-3-methyl-butyric acid 2,2,2-trichloroethyl ester Formula: C12H15Br2Cl3N2O4S MolecularWeight: 549.4905

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1C(N(C1=O)C(C(=O)OCC(Cl)(Cl)Cl)C(C)(C)SBr)Br

Isomeric SMILES

CC(=O)NC1C(N(C1=O)C(C(=O)OCC(Cl)(Cl)Cl)C(C)(C)SBr)Br

InChI

InChI=1S/C12H15Br2Cl3N2O4S/c1-5(20)18-6-8(13)19(9(6)21)7(11(2,3)24-14)10(22)23-4-12(15,16)17/h6-8H,4H2,1-3H3,(H,18,20)