7-benzamido-7-methoxy-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-3-ene-2,2-dicarboxylic acid

Systemtic Name: 7-benzamido-7-methoxy-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-3-ene-2,2-dicarboxylic acid Openeye Name: 7-benzamido-7-methoxy-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-3-ene-2,2-dicarboxylic acid CAS Name: 7-benzamido-7-methoxy-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-3-ene-2,2-dicarboxylic acid IUPAC Name: 7-benzamido-7-methoxy-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-3-ene-2,2-dicarboxylic acid Traditional Name: 7-benzamido-8-keto-7-methoxy-5-thia-1-azabicyclo[4.2.0]oct-3-ene-2,2-dicarboxylic acid Formula: C16H14N2O7S MolecularWeight: 378.35656

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Descriptors Computed from Structure

Canonical SMILES:

COC1(C2N(C1=O)C(C=CS2)(C(=O)O)C(=O)O)NC(=O)C3=CC=CC=C3

Isomeric SMILES

COC1(C2N(C1=O)C(C=CS2)(C(=O)O)C(=O)O)NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C16H14N2O7S/c1-25-16(17-10(19)9-5-3-2-4-6-9)11(20)18-12(16)26-8-7-15(18,13(21)22)14(23)24/h2-8,12H,1H3,(H,17,19)(H,21,22)(H,23,24)