1-(dimethylcarbamoyloxymethyl)-8-oxidanylidene-5-thia-1-azoniabicyclo[4.2.0]oct-2-ene-3-carboxylate hydrochloride

Systemtic Name: 1-(dimethylcarbamoyloxymethyl)-8-oxidanylidene-5-thia-1-azoniabicyclo[4.2.0]oct-2-ene-3-carboxylate hydrochloride Openeye Name: 1-(dimethylcarbamoyloxymethyl)-8-oxo-5-thia-1-azoniabicyclo[4.2.0]oct-2-ene-3-carboxylate hydrochloride CAS Name: 1-[[dimethylamino(oxo)methoxy]methyl]-8-oxo-5-thia-1-azoniabicyclo[4.2.0]oct-2-ene-3-carboxylate hydrochloride IUPAC Name: 1-(dimethylcarbamoyloxymethyl)-8-oxo-5-thia-1-azoniabicyclo[4.2.0]oct-2-ene-3-carboxylate hydrochloride Traditional Name: 1-(dimethylcarbamoyloxymethyl)-8-keto-5-thia-1-azoniabicyclo[4.2.0]oct-2-ene-3-carboxylate hydrochloride Formula: C11H15ClN2O5S MolecularWeight: 322.7652

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)OC[N+]12C=C(CSC1CC2=O)C(=O)[O-].Cl

Isomeric SMILES

CN(C)C(=O)OC[N+]12C=C(CSC1CC2=O)C(=O)[O-].Cl

InChI

InChI=1S/C11H14N2O5S.ClH/c1-12(2)11(17)18-6-13-4-7(10(15)16)5-19-9(13)3-8(13)14;/h4,9H,3,5-6H2,1-2H3;1H