2,2,2-tris(chloranyl)ethyl 3-methyl-8-oxidanylidene-7-[2,2,2-tris(chloranyl)ethanoylamino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate

Systemtic Name: 2,2,2-tris(chloranyl)ethyl 3-methyl-8-oxidanylidene-7-[2,2,2-tris(chloranyl)ethanoylamino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Openeye Name: 2,2,2-trichloroethyl 3-methyl-8-oxo-7-[(2,2,2-trichloroacetyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate CAS Name: 3-methyl-8-oxo-7-[(2,2,2-trichloro-1-oxoethyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid 2,2,2-trichloroethyl ester IUPAC Name: 2,2,2-trichloroethyl 3-methyl-8-oxo-7-[(2,2,2-trichloroacetyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Traditional Name: 8-keto-3-methyl-7-[(2,2,2-trichloroacetyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid 2,2,2-trichloroethyl ester Formula: C12H10Cl6N2O4S MolecularWeight: 491.0018

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N2C(C(C2=O)NC(=O)C(Cl)(Cl)Cl)SC1)C(=O)OCC(Cl)(Cl)Cl

Isomeric SMILES

CC1=C(N2C(C(C2=O)NC(=O)C(Cl)(Cl)Cl)SC1)C(=O)OCC(Cl)(Cl)Cl

InChI

InChI=1S/C12H10Cl6N2O4S/c1-4-2-25-8-5(19-10(23)12(16,17)18)7(21)20(8)6(4)9(22)24-3-11(13,14)15/h5,8H,2-3H2,1H3,(H,19,23)