7-[[(2E)-2-(carboxymethyloxyimino)-2-(2-formamido-1,3-thiazol-4-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-(2-formamido-1,3-thiazol-4-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-(2-formamidothiazol-4-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)-2-(2-formamido-4-thiazolyl)-1-oxoethyl]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-(2-formamido-1,3-thiazol-4-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-(2-formamidothiazol-4-yl)acetyl]amino]-8-keto-3-vinyl-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Formula: C17H15N5O8S2 MolecularWeight: 481.4597

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H15N5O8S2/c1-2-7-4-31-15-11(14(27)22(15)12(7)16(28)29)20-13(26)10(21-30-3-9(24)25)8-5-32-17(19-8)18-6-23/h2,5-6,11,15H,1,3-4H2,(H,20,26)(H,24,25)(H,28,29)(H,18,19,23)/b21-10+