3-methyl-8-oxidanylidene-7-[(2-oxidanyl-2-thiophen-2-yl-ethanoyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid

Systemtic Name: 3-methyl-8-oxidanylidene-7-[(2-oxidanyl-2-thiophen-2-yl-ethanoyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Openeye Name: 7-[[2-hydroxy-2-(2-thienyl)acetyl]amino]-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid CAS Name: 7-[(2-hydroxy-1-oxo-2-thiophen-2-ylethyl)amino]-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid IUPAC Name: 7-[(2-hydroxy-2-thiophen-2-ylacetyl)amino]-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Traditional Name: 7-[[2-hydroxy-2-(2-thienyl)acetyl]amino]-8-keto-3-methyl-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Formula: C14H14N2O5S2 MolecularWeight: 354.40136

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N2C(C(C2=O)NC(=O)C(C3=CC=CS3)O)SC1)C(=O)O

Isomeric SMILES

CC1=C(N2C(C(C2=O)NC(=O)C(C3=CC=CS3)O)SC1)C(=O)O

InChI

InChI=1S/C14H14N2O5S2/c1-6-5-23-13-8(12(19)16(13)9(6)14(20)21)15-11(18)10(17)7-3-2-4-22-7/h2-4,8,10,13,17H,5H2,1H3,(H,15,18)(H,20,21)