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

Systemtic Name: 5-methyl-1-(phenylmethyl)-1,2,3-triazole-4-carboxylic acid Openeye Name: 1-benzyl-5-methyl-triazole-4-carboxylic acid CAS Name: 5-methyl-1-(phenylmethyl)-4-triazolecarboxylic acid IUPAC Name: 1-benzyl-5-methyltriazole-4-carboxylic acid Traditional Name: 1-benzyl-5-methyl-triazole-4-carboxylic acid Formula: C11H11N3O2 MolecularWeight: 217.22394

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=NN1CC2=CC=CC=C2)C(=O)O

Isomeric SMILES

CC1=C(N=NN1CC2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C11H11N3O2/c1-8-10(11(15)16)12-13-14(8)7-9-5-3-2-4-6-9/h2-6H,7H2,1H3,(H,15,16)