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

Systemtic Name: 3-methyl-4-(1,2,3,4-tetrazol-1-yl)benzoic acid Openeye Name: 3-methyl-4-(tetrazol-1-yl)benzoic acid CAS Name: 3-methyl-4-(1-tetrazolyl)benzoic acid IUPAC Name: 3-methyl-4-(tetrazol-1-yl)benzoic acid Traditional Name: 3-methyl-4-(tetrazol-1-yl)benzoic acid Formula: C9H8N4O2 MolecularWeight: 204.18542

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)O)N2C=NN=N2

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)O)N2C=NN=N2

InChI

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