7-methyl-7-(1-methylpyrrolidin-1-ium-1-yl)-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid

Systemtic Name: 7-methyl-7-(1-methylpyrrolidin-1-ium-1-yl)-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Openeye Name: 7-methyl-7-(1-methylpyrrolidin-1-ium-1-yl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid CAS Name: 7-methyl-7-(1-methyl-1-pyrrolidin-1-iumyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid IUPAC Name: 7-methyl-7-(1-methylpyrrolidin-1-ium-1-yl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Traditional Name: 8-keto-7-methyl-7-(1-methylpyrrolidin-1-ium-1-yl)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Formula: C13H19N2O3S+ MolecularWeight: 283.36656

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2N(C1=O)C(=CCS2)C(=O)O)[N+]3(CCCC3)C

Isomeric SMILES

CC1(C2N(C1=O)C(=CCS2)C(=O)O)[N+]3(CCCC3)C

InChI

InChI=1S/C13H18N2O3S/c1-13(15(2)6-3-4-7-15)11(18)14-9(10(16)17)5-8-19-12(13)14/h5,12H,3-4,6-8H2,1-2H3/p+1