3-(1-methyl-1,2,3,4-tetrazol-5-yl)benzoate

Systemtic Name: 3-(1-methyl-1,2,3,4-tetrazol-5-yl)benzoate Openeye Name: 3-(1-methyltetrazol-5-yl)benzoate CAS Name: 3-(1-methyl-5-tetrazolyl)benzoate IUPAC Name: 3-(1-methyltetrazol-5-yl)benzoate Traditional Name: 3-(1-methyltetrazol-5-yl)benzoate Formula: C9H7N4O2- MolecularWeight: 203.17748

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=N1)C2=CC(=CC=C2)C(=O)[O-]

Isomeric SMILES

CN1C(=NN=N1)C2=CC(=CC=C2)C(=O)[O-]

InChI

InChI=1S/C9H8N4O2/c1-13-8(10-11-12-13)6-3-2-4-7(5-6)9(14)15/h2-5H,1H3,(H,14,15)/p-1