1-[[(5R)-3-dibenzo-p-dioxin-2-yl-2-oxidanylidene-1,3-oxazolidin-5-yl]methyl]-1,2,3-triazole-4-carboxylic acid

Systemtic Name: 1-[[(5R)-3-dibenzo-p-dioxin-2-yl-2-oxidanylidene-1,3-oxazolidin-5-yl]methyl]-1,2,3-triazole-4-carboxylic acid Openeye Name: 1-[[(5R)-3-dibenzo-p-dioxin-2-yl-2-oxo-oxazolidin-5-yl]methyl]triazole-4-carboxylic acid CAS Name: 1-[[(5R)-3-(2-dibenzo-p-dioxinyl)-2-oxo-5-oxazolidinyl]methyl]-4-triazolecarboxylic acid IUPAC Name: 1-[[(5R)-3-dibenzo-p-dioxin-2-yl-2-oxo-1,3-oxazolidin-5-yl]methyl]triazole-4-carboxylic acid Traditional Name: 1-[[(5R)-3-dibenzo-p-dioxin-2-yl-2-keto-oxazolidin-5-yl]methyl]triazole-4-carboxylic acid Formula: C19H14N4O6 MolecularWeight: 394.33766

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC(=O)N1C2=CC3=C(C=C2)OC4=CC=CC=C4O3)CN5C=C(N=N5)C(=O)O

Isomeric SMILES

C1[C@@H](OC(=O)N1C2=CC3=C(C=C2)OC4=CC=CC=C4O3)CN5C=C(N=N5)C(=O)O

InChI

InChI=1S/C19H14N4O6/c24-18(25)13-10-22(21-20-13)8-12-9-23(19(26)27-12)11-5-6-16-17(7-11)29-15-4-2-1-3-14(15)28-16/h1-7,10,12H,8-9H2,(H,24,25)/t12-/m0/s1