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

Systemtic Name: 6-(1-hydroxyethyl)-7-oxidanylidene-3-(3-oxidanylphenoxy)-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid Openeye Name: 6-(1-hydroxyethyl)-3-(3-hydroxyphenoxy)-7-oxo-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid CAS Name: 6-(1-hydroxyethyl)-3-(3-hydroxyphenoxy)-7-oxo-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid IUPAC Name: 6-(1-hydroxyethyl)-3-(3-hydroxyphenoxy)-7-oxo-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid Traditional Name: 6-(1-hydroxyethyl)-3-(3-hydroxyphenoxy)-7-keto-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid Formula: C14H13NO6S MolecularWeight: 323.32112

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1C2N(C1=O)C(=C(S2)OC3=CC=CC(=C3)O)C(=O)O)O

Isomeric SMILES

CC(C1C2N(C1=O)C(=C(S2)OC3=CC=CC(=C3)O)C(=O)O)O

InChI

InChI=1S/C14H13NO6S/c1-6(16)9-11(18)15-10(13(19)20)14(22-12(9)15)21-8-4-2-3-7(17)5-8/h2-6,9,12,16-17H,1H3,(H,19,20)