1-(1-oxidanyl-1-oxidanylidene-butan-2-yl)-1,2,3-triazole-4-carboxylic acid

Systemtic Name: 1-(1-oxidanyl-1-oxidanylidene-butan-2-yl)-1,2,3-triazole-4-carboxylic acid Openeye Name: 1-(1-carboxypropyl)triazole-4-carboxylic acid CAS Name: 1-(1-hydroxy-1-oxobutan-2-yl)-4-triazolecarboxylic acid IUPAC Name: 1-(1-hydroxy-1-oxobutan-2-yl)triazole-4-carboxylic acid Traditional Name: 1-(1-carboxypropyl)triazole-4-carboxylic acid Formula: C7H9N3O4 MolecularWeight: 199.16406

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)O)N1C=C(N=N1)C(=O)O

Isomeric SMILES

CCC(C(=O)O)N1C=C(N=N1)C(=O)O

InChI

InChI=1S/C7H9N3O4/c1-2-5(7(13)14)10-3-4(6(11)12)8-9-10/h3,5H,2H2,1H3,(H,11,12)(H,13,14)