6-(1-hydroxyethyl)-7-oxidanylidene-3-pyrazol-1-yl-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate

Systemtic Name: 6-(1-hydroxyethyl)-7-oxidanylidene-3-pyrazol-1-yl-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate Openeye Name: 6-(1-hydroxyethyl)-7-oxo-3-pyrazol-1-yl-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate CAS Name: 6-(1-hydroxyethyl)-7-oxo-3-(1-pyrazolyl)-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate IUPAC Name: 6-(1-hydroxyethyl)-7-oxo-3-pyrazol-1-yl-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate Traditional Name: 6-(1-hydroxyethyl)-7-keto-3-pyrazol-1-yl-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate Formula: C11H10N3O4S- MolecularWeight: 280.2798

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1C2N(C1=O)C(=C(S2)N3C=CC=N3)C(=O)[O-])O

Isomeric SMILES

CC(C1C2N(C1=O)C(=C(S2)N3C=CC=N3)C(=O)[O-])O

InChI

InChI=1S/C11H11N3O4S/c1-5(15)6-8(16)14-7(11(17)18)10(19-9(6)14)13-4-2-3-12-13/h2-6,9,15H,1H3,(H,17,18)/p-1