1-[1,3-bis(oxidanyl)propan-2-yl]benzotriazole-5-carboxylic acid

Systemtic Name: 1-[1,3-bis(oxidanyl)propan-2-yl]benzotriazole-5-carboxylic acid Openeye Name: 1-[2-hydroxy-1-(hydroxymethyl)ethyl]benzotriazole-5-carboxylic acid CAS Name: 1-(1,3-dihydroxypropan-2-yl)-5-benzotriazolecarboxylic acid IUPAC Name: 1-(1,3-dihydroxypropan-2-yl)benzotriazole-5-carboxylic acid Traditional Name: 1-(2-hydroxy-1-methylol-ethyl)benzotriazole-5-carboxylic acid Formula: C10H11N3O4 MolecularWeight: 237.21204

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1C(=O)O)N=NN2C(CO)CO

Isomeric SMILES

C1=CC2=C(C=C1C(=O)O)N=NN2C(CO)CO

InChI

InChI=1S/C10H11N3O4/c14-4-7(5-15)13-9-2-1-6(10(16)17)3-8(9)11-12-13/h1-3,7,14-15H,4-5H2,(H,16,17)