1-methyl-3-[3-(1,2,3,4-tetrazol-1-yl)phenyl]pyrazole-4-carboxylic acid

Systemtic Name: 1-methyl-3-[3-(1,2,3,4-tetrazol-1-yl)phenyl]pyrazole-4-carboxylic acid Openeye Name: 1-methyl-3-[3-(tetrazol-1-yl)phenyl]pyrazole-4-carboxylic acid CAS Name: 1-methyl-3-[3-(1-tetrazolyl)phenyl]-4-pyrazolecarboxylic acid IUPAC Name: 1-methyl-3-[3-(tetrazol-1-yl)phenyl]pyrazole-4-carboxylic acid Traditional Name: 1-methyl-3-[3-(tetrazol-1-yl)phenyl]pyrazole-4-carboxylic acid Formula: C12H10N6O2 MolecularWeight: 270.2468

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=N1)C2=CC(=CC=C2)N3C=NN=N3)C(=O)O

Isomeric SMILES

CN1C=C(C(=N1)C2=CC(=CC=C2)N3C=NN=N3)C(=O)O

InChI

InChI=1S/C12H10N6O2/c1-17-6-10(12(19)20)11(14-17)8-3-2-4-9(5-8)18-7-13-15-16-18/h2-7H,1H3,(H,19,20)