7-azanyl-3-[6-(hydroxymethyl)dibenzofuran-3-yl]sulfanyl-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid

Systemtic Name: 7-azanyl-3-[6-(hydroxymethyl)dibenzofuran-3-yl]sulfanyl-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Openeye Name: 7-amino-3-[6-(hydroxymethyl)dibenzofuran-3-yl]sulfanyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid CAS Name: 7-amino-3-[[6-(hydroxymethyl)-3-dibenzofuranyl]thio]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid IUPAC Name: 7-amino-3-[6-(hydroxymethyl)dibenzofuran-3-yl]sulfanyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Traditional Name: 7-amino-8-keto-3-[(6-methyloldibenzofuran-3-yl)thio]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Formula: C20H16N2O5S2 MolecularWeight: 428.48144

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=C(N2C(S1)C(C2=O)N)C(=O)O)SC3=CC4=C(C=C3)C5=C(O4)C(=CC=C5)CO

Isomeric SMILES

C1C(=C(N2C(S1)C(C2=O)N)C(=O)O)SC3=CC4=C(C=C3)C5=C(O4)C(=CC=C5)CO

InChI

InChI=1S/C20H16N2O5S2/c21-15-18(24)22-16(20(25)26)14(8-28-19(15)22)29-10-4-5-11-12-3-1-2-9(7-23)17(12)27-13(11)6-10/h1-6,15,19,23H,7-8,21H2,(H,25,26)