sodium [4-[[(E)-2-chloranylethenyl]-ethanethioyl-amino]-3-oxidanylidene-1,2-oxazolidin-2-yl] 5-oxidanylideneoxolane-2-carboxylate

Systemtic Name: sodium [4-[[(E)-2-chloranylethenyl]-ethanethioyl-amino]-3-oxidanylidene-1,2-oxazolidin-2-yl] 5-oxidanylideneoxolane-2-carboxylate Openeye Name: sodium [4-[[(E)-2-chlorovinyl]-ethanethioyl-amino]-3-oxo-isoxazolidin-2-yl] 5-oxotetrahydrofuran-2-carboxylate CAS Name: sodium 5-oxo-2-oxolanecarboxylic acid [4-[[(E)-2-chloroethenyl]-(1-sulfanylideneethyl)amino]-3-oxo-2-isoxazolidinyl] ester IUPAC Name: sodium [4-[[(E)-2-chloroethenyl]-ethanethioylamino]-3-oxo-1,2-oxazolidin-2-yl] 5-oxooxolane-2-carboxylate Traditional Name: sodium 5-ketotetrahydrofuran-2-carboxylic acid [4-[[(E)-2-chlorovinyl]-thioacetyl-amino]-3-keto-isoxazolidin-2-yl] ester Formula: C12H13ClN2NaO6S+ MolecularWeight: 371.74919

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Descriptors Computed from Structure

Canonical SMILES:

CC(=S)N(C=CCl)C1CON(C1=O)OC(=O)C2CCC(=O)O2.[Na+]

Isomeric SMILES

CC(=S)N(/C=C/Cl)C1CON(C1=O)OC(=O)C2CCC(=O)O2.[Na+]

InChI

InChI=1S/C12H13ClN2O6S.Na/c1-7(22)14(5-4-13)8-6-19-15(11(8)17)21-12(18)9-2-3-10(16)20-9;/h4-5,8-9H,2-3,6H2,1H3;/q;+1/b5-4+;