7-azanyl-3-(5-methoxycarbonyloxolan-2-yl)-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid

Systemtic Name: 7-azanyl-3-(5-methoxycarbonyloxolan-2-yl)-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Openeye Name: 7-amino-3-(5-methoxycarbonyltetrahydrofuran-2-yl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid CAS Name: 7-amino-3-(5-methoxycarbonyl-2-oxolanyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid IUPAC Name: 7-amino-3-(5-methoxycarbonyloxolan-2-yl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Traditional Name: 7-amino-3-(5-carbomethoxytetrahydrofuran-2-yl)-8-keto-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Formula: C13H16N2O6S MolecularWeight: 328.34094

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CCC(O1)C2=C(N3C(C(C3=O)N)SC2)C(=O)O

Isomeric SMILES

COC(=O)C1CCC(O1)C2=C(N3C(C(C3=O)N)SC2)C(=O)O

InChI

InChI=1S/C13H16N2O6S/c1-20-13(19)7-3-2-6(21-7)5-4-22-11-8(14)10(16)15(11)9(5)12(17)18/h6-8,11H,2-4,14H2,1H3,(H,17,18)