3-[(3-methylthiophen-2-yl)methyl]-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid

Systemtic Name: 3-[(3-methylthiophen-2-yl)methyl]-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Openeye Name: 3-[(3-methyl-2-thienyl)methyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid CAS Name: 3-[(3-methyl-2-thiophenyl)methyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid IUPAC Name: 3-[(3-methylthiophen-2-yl)methyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Traditional Name: 8-keto-3-[(3-methyl-2-thienyl)methyl]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Formula: C13H13NO3S2 MolecularWeight: 295.37722

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)CC2=C(N3C(CC3=O)SC2)C(=O)O

Isomeric SMILES

CC1=C(SC=C1)CC2=C(N3C(CC3=O)SC2)C(=O)O

InChI

InChI=1S/C13H13NO3S2/c1-7-2-3-18-9(7)4-8-6-19-11-5-10(15)14(11)12(8)13(16)17/h2-3,11H,4-6H2,1H3,(H,16,17)