7-[[(2E)-2-(carboxymethyloxyimino)-2-(1,2,4-thiadiazol-3-yl)ethanoyl]amino]-3-ethenyl-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid

Systemtic Name: 7-[[(2E)-2-(carboxymethyloxyimino)-2-(1,2,4-thiadiazol-3-yl)ethanoyl]amino]-3-ethenyl-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Openeye Name: 7-[[(2E)-2-(carboxymethyloxyimino)-2-(1,2,4-thiadiazol-3-yl)acetyl]amino]-8-oxo-3-vinyl-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid CAS Name: 7-[[(2E)-2-(carboxymethyloxyimino)-1-oxo-2-(1,2,4-thiadiazol-3-yl)ethyl]amino]-3-ethenyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid IUPAC Name: 7-[[(2E)-2-(carboxymethyloxyimino)-2-(1,2,4-thiadiazol-3-yl)acetyl]amino]-3-ethenyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Traditional Name: 7-[[(2E)-2-(carboxymethyloximino)-2-(1,2,4-thiadiazol-3-yl)acetyl]amino]-8-keto-3-vinyl-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Formula: C15H13N5O7S2 MolecularWeight: 439.42302

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Descriptors Computed from Structure

Canonical SMILES:

C=CC1=C(N2C(C(C2=O)NC(=O)C(=NOCC(=O)O)C3=NSC=N3)SC1)C(=O)O

Isomeric SMILES

C=CC1=C(N2C(C(C2=O)NC(=O)/C(=N/OCC(=O)O)/C3=NSC=N3)SC1)C(=O)O

InChI

InChI=1S/C15H13N5O7S2/c1-2-6-4-28-14-9(13(24)20(14)10(6)15(25)26)17-12(23)8(11-16-5-29-19-11)18-27-3-7(21)22/h2,5,9,14H,1,3-4H2,(H,17,23)(H,21,22)(H,25,26)/b18-8+