3-(4-carboxypyridin-3-yl)-6-(1-hydroxyethyl)-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid

Systemtic Name: 3-(4-carboxypyridin-3-yl)-6-(1-hydroxyethyl)-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid Openeye Name: 3-(4-carboxy-3-pyridyl)-6-(1-hydroxyethyl)-7-oxo-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid CAS Name: 3-(4-carboxy-3-pyridinyl)-6-(1-hydroxyethyl)-7-oxo-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid IUPAC Name: 3-(4-carboxypyridin-3-yl)-6-(1-hydroxyethyl)-7-oxo-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid Traditional Name: 3-(4-carboxy-3-pyridyl)-6-(1-hydroxyethyl)-7-keto-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid Formula: C14H12N2O6S MolecularWeight: 336.31988

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H12N2O6S/c1-5(17)8-11(18)16-9(14(21)22)10(23-12(8)16)7-4-15-3-2-6(7)13(19)20/h2-5,8,12,17H,1H3,(H,19,20)(H,21,22)