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

Systemtic Name: 3-(3-azanylphenoxy)-6-(1-hydroxyethyl)-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate Openeye Name: 3-(3-aminophenoxy)-6-(1-hydroxyethyl)-7-oxo-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate CAS Name: 3-(3-aminophenoxy)-6-(1-hydroxyethyl)-7-oxo-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate IUPAC Name: 3-(3-aminophenoxy)-6-(1-hydroxyethyl)-7-oxo-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate Traditional Name: 3-(3-aminophenoxy)-6-(1-hydroxyethyl)-7-keto-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate Formula: C14H13N2O5S- MolecularWeight: 321.32842

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1C2N(C1=O)C(=C(S2)OC3=CC=CC(=C3)N)C(=O)[O-])O

Isomeric SMILES

CC(C1C2N(C1=O)C(=C(S2)OC3=CC=CC(=C3)N)C(=O)[O-])O

InChI

InChI=1S/C14H14N2O5S/c1-6(17)9-11(18)16-10(13(19)20)14(22-12(9)16)21-8-4-2-3-7(15)5-8/h2-6,9,12,17H,15H2,1H3,(H,19,20)/p-1