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

Systemtic Name: [3-(1,2,3,4-tetrazol-1-yl)phenyl] 3-butoxybenzoate Openeye Name: [3-(tetrazol-1-yl)phenyl] 3-butoxybenzoate CAS Name: 3-butoxybenzoic acid [3-(1-tetrazolyl)phenyl] ester IUPAC Name: [3-(tetrazol-1-yl)phenyl] 3-butoxybenzoate Traditional Name: 3-butoxybenzoic acid [3-(tetrazol-1-yl)phenyl] ester Formula: C18H18N4O3 MolecularWeight: 338.36052

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=CC(=C1)C(=O)OC2=CC=CC(=C2)N3C=NN=N3

Isomeric SMILES

CCCCOC1=CC=CC(=C1)C(=O)OC2=CC=CC(=C2)N3C=NN=N3

InChI

InChI=1S/C18H18N4O3/c1-2-3-10-24-16-8-4-6-14(11-16)18(23)25-17-9-5-7-15(12-17)22-13-19-20-21-22/h4-9,11-13H,2-3,10H2,1H3