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

Systemtic Name: 2-(phenylmethyl)-1,2,3,4-tetrazole-5-carboxylic acid Openeye Name: 2-benzyltetrazole-5-carboxylic acid CAS Name: 2-(phenylmethyl)-5-tetrazolecarboxylic acid IUPAC Name: 2-benzyltetrazole-5-carboxylic acid Traditional Name: 2-benzyltetrazole-5-carboxylic acid Formula: C9H8N4O2 MolecularWeight: 204.18542

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2N=C(N=N2)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CN2N=C(N=N2)C(=O)O

InChI

InChI=1S/C9H8N4O2/c14-9(15)8-10-12-13(11-8)6-7-4-2-1-3-5-7/h1-5H,6H2,(H,14,15)