methyl 1-(2-methyl-1,2,3,4-tetrazol-5-yl)cyclohepta-2,4,6-triene-1-carboxylate

Systemtic Name: methyl 1-(2-methyl-1,2,3,4-tetrazol-5-yl)cyclohepta-2,4,6-triene-1-carboxylate Openeye Name: methyl 1-(2-methyltetrazol-5-yl)cyclohepta-2,4,6-triene-1-carboxylate CAS Name: 1-(2-methyl-5-tetrazolyl)-1-cyclohepta-2,4,6-trienecarboxylic acid methyl ester IUPAC Name: methyl 1-(2-methyltetrazol-5-yl)cyclohepta-2,4,6-triene-1-carboxylate Traditional Name: 1-(2-methyltetrazol-5-yl)cyclohepta-2,4,6-triene-1-carboxylic acid methyl ester Formula: C11H12N4O2 MolecularWeight: 232.23858

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1N=C(N=N1)C2(C=CC=CC=C2)C(=O)OC

Isomeric SMILES

CN1N=C(N=N1)C2(C=CC=CC=C2)C(=O)OC

InChI

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