6-[2-(2-carboxyphenyl)ethanoylamino]-7-oxidanylidene-3-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid

Systemtic Name: 6-[2-(2-carboxyphenyl)ethanoylamino]-7-oxidanylidene-3-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid Openeye Name: 6-[[2-(2-carboxyphenyl)acetyl]amino]-7-oxo-3-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid CAS Name: 6-[[2-(2-carboxyphenyl)-1-oxoethyl]amino]-7-oxo-3-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid IUPAC Name: 6-[[2-(2-carboxyphenyl)acetyl]amino]-7-oxo-3-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid Traditional Name: 6-[[2-(2-carboxyphenyl)acetyl]amino]-7-keto-3-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid Formula: C15H14N2O6S MolecularWeight: 350.34646

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Descriptors Computed from Structure

Canonical SMILES:

C1C2C(C(=O)N2C(S1)C(=O)O)NC(=O)CC3=CC=CC=C3C(=O)O

Isomeric SMILES

C1C2C(C(=O)N2C(S1)C(=O)O)NC(=O)CC3=CC=CC=C3C(=O)O

InChI

InChI=1S/C15H14N2O6S/c18-10(5-7-3-1-2-4-8(7)14(20)21)16-11-9-6-24-13(15(22)23)17(9)12(11)19/h1-4,9,11,13H,5-6H2,(H,16,18)(H,20,21)(H,22,23)