8-oxidanylidene-7-[(5-oxidanyl-4-oxidanylidene-1H-pyridin-2-yl)-prop-2-enoyloxy-methyl]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid

Systemtic Name: 8-oxidanylidene-7-[(5-oxidanyl-4-oxidanylidene-1H-pyridin-2-yl)-prop-2-enoyloxy-methyl]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Openeye Name: 7-[(5-hydroxy-4-oxo-1H-pyridin-2-yl)-prop-2-enoyloxy-methyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid CAS Name: 7-[(5-hydroxy-4-oxo-1H-pyridin-2-yl)-(1-oxoprop-2-enoxy)methyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid IUPAC Name: 7-[(5-hydroxy-4-oxo-1H-pyridin-2-yl)-prop-2-enoyloxymethyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Traditional Name: 7-[acryloyloxy-(5-hydroxy-4-keto-1H-pyridin-2-yl)methyl]-8-keto-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Formula: C16H14N2O7S MolecularWeight: 378.35656

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Descriptors Computed from Structure

Canonical SMILES:

C=CC(=O)OC(C1C2N(C1=O)C(=CCS2)C(=O)O)C3=CC(=O)C(=CN3)O

Isomeric SMILES

C=CC(=O)OC(C1C2N(C1=O)C(=CCS2)C(=O)O)C3=CC(=O)C(=CN3)O

InChI

InChI=1S/C16H14N2O7S/c1-2-11(21)25-13(7-5-9(19)10(20)6-17-7)12-14(22)18-8(16(23)24)3-4-26-15(12)18/h2-3,5-6,12-13,15,20H,1,4H2,(H,17,19)(H,23,24)