2-[3-oxidanyl-3-(1H-1,2,4-triazol-5-yl)propyl]propanedioic acid

Systemtic Name: 2-[3-oxidanyl-3-(1H-1,2,4-triazol-5-yl)propyl]propanedioic acid Openeye Name: 2-[3-hydroxy-3-(1H-1,2,4-triazol-5-yl)propyl]propanedioic acid CAS Name: 2-[3-hydroxy-3-(1H-1,2,4-triazol-5-yl)propyl]propanedioic acid IUPAC Name: 2-[3-hydroxy-3-(1H-1,2,4-triazol-5-yl)propyl]propanedioic acid Traditional Name: 2-[3-hydroxy-3-(1H-1,2,4-triazol-5-yl)propyl]malonic acid Formula: C8H11N3O5 MolecularWeight: 229.19004

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Descriptors Computed from Structure

Canonical SMILES:

C1=NNC(=N1)C(CCC(C(=O)O)C(=O)O)O

Isomeric SMILES

C1=NNC(=N1)C(CCC(C(=O)O)C(=O)O)O

InChI

InChI=1S/C8H11N3O5/c12-5(6-9-3-10-11-6)2-1-4(7(13)14)8(15)16/h3-5,12H,1-2H2,(H,13,14)(H,15,16)(H,9,10,11)