3-(acetyloxymethyl)-4-[[(2Z)-2-(5-azanyl-1,2,4-oxadiazol-3-yl)-2-methoxyimino-ethanoyl]amino]-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid

Systemtic Name: 3-(acetyloxymethyl)-4-[[(2Z)-2-(5-azanyl-1,2,4-oxadiazol-3-yl)-2-methoxyimino-ethanoyl]amino]-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Openeye Name: 3-(acetoxymethyl)-4-[[(2Z)-2-(5-amino-1,2,4-oxadiazol-3-yl)-2-methoxyimino-acetyl]amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid CAS Name: 3-(acetyloxymethyl)-4-[[(2Z)-2-(5-amino-1,2,4-oxadiazol-3-yl)-2-methoxyimino-1-oxoethyl]amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid IUPAC Name: 3-(acetyloxymethyl)-4-[[(2Z)-2-(5-amino-1,2,4-oxadiazol-3-yl)-2-methoxyiminoacetyl]amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Traditional Name: 3-(acetoxymethyl)-4-[[(2Z)-2-(5-amino-1,2,4-oxadiazol-3-yl)-2-methyloximino-acetyl]amino]-8-keto-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Formula: C15H16N6O8S MolecularWeight: 440.38794

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC1=C(N2C(CC2=O)SC1NC(=O)C(=NOC)C3=NOC(=N3)N)C(=O)O

Isomeric SMILES

CC(=O)OCC1=C(N2C(CC2=O)SC1NC(=O)/C(=N\OC)/C3=NOC(=N3)N)C(=O)O

InChI

InChI=1S/C15H16N6O8S/c1-5(22)28-4-6-10(14(25)26)21-7(23)3-8(21)30-13(6)18-12(24)9(19-27-2)11-17-15(16)29-20-11/h8,13H,3-4H2,1-2H3,(H,18,24)(H,25,26)(H2,16,17,20)/b19-9-