3-(4-carboxyphenyl)-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid

Systemtic Name: 3-(4-carboxyphenyl)-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid Openeye Name: 3-(4-carboxyphenyl)-7-oxo-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid CAS Name: 3-(4-carboxyphenyl)-7-oxo-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid IUPAC Name: 3-(4-carboxyphenyl)-7-oxo-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid Traditional Name: 3-(4-carboxyphenyl)-7-keto-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid Formula: C13H9NO5S MolecularWeight: 291.27926

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Descriptors Computed from Structure

Canonical SMILES:

C1C2N(C1=O)C(=C(S2)C3=CC=C(C=C3)C(=O)O)C(=O)O

Isomeric SMILES

C1C2N(C1=O)C(=C(S2)C3=CC=C(C=C3)C(=O)O)C(=O)O

InChI

InChI=1S/C13H9NO5S/c15-8-5-9-14(8)10(13(18)19)11(20-9)6-1-3-7(4-2-6)12(16)17/h1-4,9H,5H2,(H,16,17)(H,18,19)