1-(phenylmethyl)-1,2,3-triazole-4,5-dicarboxylic acid

Systemtic Name: 1-(phenylmethyl)-1,2,3-triazole-4,5-dicarboxylic acid Openeye Name: 1-benzyltriazole-4,5-dicarboxylic acid CAS Name: 1-(phenylmethyl)triazole-4,5-dicarboxylic acid IUPAC Name: 1-benzyltriazole-4,5-dicarboxylic acid Traditional Name: 1-benzyltriazole-4,5-dicarboxylic acid Formula: C11H9N3O4 MolecularWeight: 247.20686

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C(=C(N=N2)C(=O)O)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CN2C(=C(N=N2)C(=O)O)C(=O)O

InChI

InChI=1S/C11H9N3O4/c15-10(16)8-9(11(17)18)14(13-12-8)6-7-4-2-1-3-5-7/h1-5H,6H2,(H,15,16)(H,17,18)