1-[2-oxidanyl-3-propyl-4-[[3-(2H-1,2,3,4-tetrazol-5-ylmethyl)phenoxy]methyl]phenyl]ethanone

Systemtic Name: 1-[2-oxidanyl-3-propyl-4-[[3-(2H-1,2,3,4-tetrazol-5-ylmethyl)phenoxy]methyl]phenyl]ethanone Openeye Name: 1-[2-hydroxy-3-propyl-4-[[3-(2H-tetrazol-5-ylmethyl)phenoxy]methyl]phenyl]ethanone CAS Name: 1-[2-hydroxy-3-propyl-4-[[3-(2H-tetrazol-5-ylmethyl)phenoxy]methyl]phenyl]ethanone IUPAC Name: 1-[2-hydroxy-3-propyl-4-[[3-(2H-tetrazol-5-ylmethyl)phenoxy]methyl]phenyl]ethanone Traditional Name: 1-[2-hydroxy-3-propyl-4-[[3-(2H-tetrazol-5-ylmethyl)phenoxy]methyl]phenyl]ethanone Formula: C20H22N4O3 MolecularWeight: 366.41368

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1O)C(=O)C)COC2=CC=CC(=C2)CC3=NNN=N3

Isomeric SMILES

CCCC1=C(C=CC(=C1O)C(=O)C)COC2=CC=CC(=C2)CC3=NNN=N3

InChI

InChI=1S/C20H22N4O3/c1-3-5-18-15(8-9-17(13(2)25)20(18)26)12-27-16-7-4-6-14(10-16)11-19-21-23-24-22-19/h4,6-10,26H,3,5,11-12H2,1-2H3,(H,21,22,23,24)