[3-(1,2,3,4-tetrazol-1-yl)phenyl] 4-(2-methylpropoxy)benzoate

Systemtic Name: [3-(1,2,3,4-tetrazol-1-yl)phenyl] 4-(2-methylpropoxy)benzoate Openeye Name: [3-(tetrazol-1-yl)phenyl] 4-isobutoxybenzoate CAS Name: 4-(2-methylpropoxy)benzoic acid [3-(1-tetrazolyl)phenyl] ester IUPAC Name: [3-(tetrazol-1-yl)phenyl] 4-(2-methylpropoxy)benzoate Traditional Name: 4-isobutoxybenzoic acid [3-(tetrazol-1-yl)phenyl] ester Formula: C18H18N4O3 MolecularWeight: 338.36052

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=CC=C(C=C1)C(=O)OC2=CC=CC(=C2)N3C=NN=N3

Isomeric SMILES

CC(C)COC1=CC=C(C=C1)C(=O)OC2=CC=CC(=C2)N3C=NN=N3

InChI

InChI=1S/C18H18N4O3/c1-13(2)11-24-16-8-6-14(7-9-16)18(23)25-17-5-3-4-15(10-17)22-12-19-20-21-22/h3-10,12-13H,11H2,1-2H3