4-(5-pyridin-4-yl-1,2,3,4-tetrazol-2-yl)benzoic acid

Systemtic Name: 4-(5-pyridin-4-yl-1,2,3,4-tetrazol-2-yl)benzoic acid Openeye Name: 4-[5-(4-pyridyl)tetrazol-2-yl]benzoic acid CAS Name: 4-(5-pyridin-4-yl-2-tetrazolyl)benzoic acid IUPAC Name: 4-(5-pyridin-4-yltetrazol-2-yl)benzoic acid Traditional Name: 4-[5-(4-pyridyl)tetrazol-2-yl]benzoic acid Formula: C13H9N5O2 MolecularWeight: 267.24286

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)O)N2N=C(N=N2)C3=CC=NC=C3

Isomeric SMILES

C1=CC(=CC=C1C(=O)O)N2N=C(N=N2)C3=CC=NC=C3

InChI

InChI=1S/C13H9N5O2/c19-13(20)10-1-3-11(4-2-10)18-16-12(15-17-18)9-5-7-14-8-6-9/h1-8H,(H,19,20)