(1-phenyl-1,2,3,4-tetrazol-5-yl)methyl 3-(4-fluorophenyl)-1H-pyrazole-5-carboxylate

Systemtic Name: (1-phenyl-1,2,3,4-tetrazol-5-yl)methyl 3-(4-fluorophenyl)-1H-pyrazole-5-carboxylate Openeye Name: (1-phenyltetrazol-5-yl)methyl 3-(4-fluorophenyl)-1H-pyrazole-5-carboxylate CAS Name: 3-(4-fluorophenyl)-1H-pyrazole-5-carboxylic acid (1-phenyl-5-tetrazolyl)methyl ester IUPAC Name: (1-phenyltetrazol-5-yl)methyl 3-(4-fluorophenyl)-1H-pyrazole-5-carboxylate Traditional Name: 3-(4-fluorophenyl)-1H-pyrazole-5-carboxylic acid (1-phenyltetrazol-5-yl)methyl ester Formula: C18H13FN6O2 MolecularWeight: 364.333223

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=NN=N2)COC(=O)C3=CC(=NN3)C4=CC=C(C=C4)F

Isomeric SMILES

C1=CC=C(C=C1)N2C(=NN=N2)COC(=O)C3=CC(=NN3)C4=CC=C(C=C4)F

InChI

InChI=1S/C18H13FN6O2/c19-13-8-6-12(7-9-13)15-10-16(21-20-15)18(26)27-11-17-22-23-24-25(17)14-4-2-1-3-5-14/h1-10H,11H2,(H,20,21)