ethyl 2-(phenylmethyl)-1,2,3,4-tetrazole-5-carboxylate

Systemtic Name: ethyl 2-(phenylmethyl)-1,2,3,4-tetrazole-5-carboxylate Openeye Name: ethyl 2-benzyltetrazole-5-carboxylate CAS Name: 2-(phenylmethyl)-5-tetrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-benzyltetrazole-5-carboxylate Traditional Name: 2-benzyltetrazole-5-carboxylic acid ethyl ester Formula: C11H12N4O2 MolecularWeight: 232.23858

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(N=N1)CC2=CC=CC=C2

Isomeric SMILES

CCOC(=O)C1=NN(N=N1)CC2=CC=CC=C2

InChI

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