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

Systemtic Name: 3-(2-propyl-1,2,3,4-tetrazol-5-yl)benzoic acid Openeye Name: 3-(2-propyltetrazol-5-yl)benzoic acid CAS Name: 3-(2-propyl-5-tetrazolyl)benzoic acid IUPAC Name: 3-(2-propyltetrazol-5-yl)benzoic acid Traditional Name: 3-(2-propyltetrazol-5-yl)benzoic acid Formula: C11H12N4O2 MolecularWeight: 232.23858

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN1N=C(N=N1)C2=CC(=CC=C2)C(=O)O

Isomeric SMILES

CCCN1N=C(N=N1)C2=CC(=CC=C2)C(=O)O

InChI

InChI=1S/C11H12N4O2/c1-2-6-15-13-10(12-14-15)8-4-3-5-9(7-8)11(16)17/h3-5,7H,2,6H2,1H3,(H,16,17)