7-[(2-ethoxy-4-oxidanyl-phenyl)carbonylamino]-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid

Systemtic Name: 7-[(2-ethoxy-4-oxidanyl-phenyl)carbonylamino]-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Openeye Name: 7-[(2-ethoxy-4-hydroxy-benzoyl)amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid CAS Name: 7-[[(2-ethoxy-4-hydroxyphenyl)-oxomethyl]amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid IUPAC Name: 7-[(2-ethoxy-4-hydroxybenzoyl)amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Traditional Name: 7-[(2-ethoxy-4-hydroxy-benzoyl)amino]-8-keto-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Formula: C16H16N2O6S MolecularWeight: 364.37304

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)O)C(=O)NC2C3N(C2=O)C(=CCS3)C(=O)O

Isomeric SMILES

CCOC1=C(C=CC(=C1)O)C(=O)NC2C3N(C2=O)C(=CCS3)C(=O)O

InChI

InChI=1S/C16H16N2O6S/c1-2-24-11-7-8(19)3-4-9(11)13(20)17-12-14(21)18-10(16(22)23)5-6-25-15(12)18/h3-5,7,12,15,19H,2,6H2,1H3,(H,17,20)(H,22,23)