ethyl 4-[[2-(3-methylphenyl)-1,2,3,4-tetrazol-5-yl]methyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[[2-(3-methylphenyl)-1,2,3,4-tetrazol-5-yl]methyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[[2-(m-tolyl)tetrazol-5-yl]methyl]piperazine-1-carboxylate CAS Name: 4-[[2-(3-methylphenyl)-5-tetrazolyl]methyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[[2-(3-methylphenyl)tetrazol-5-yl]methyl]piperazine-1-carboxylate Traditional Name: 4-[[2-(m-tolyl)tetrazol-5-yl]methyl]piperazine-1-carboxylic acid ethyl ester Formula: C16H22N6O2 MolecularWeight: 330.38488

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)CC2=NN(N=N2)C3=CC=CC(=C3)C

Isomeric SMILES

CCOC(=O)N1CCN(CC1)CC2=NN(N=N2)C3=CC=CC(=C3)C

InChI

InChI=1S/C16H22N6O2/c1-3-24-16(23)21-9-7-20(8-10-21)12-15-17-19-22(18-15)14-6-4-5-13(2)11-14/h4-6,11H,3,7-10,12H2,1-2H3