3-butoxypropyl-[[2-[(4-methylphenyl)methoxy]phenyl]methyl]azanium

Systemtic Name: 3-butoxypropyl-[[2-[(4-methylphenyl)methoxy]phenyl]methyl]azanium Openeye Name: 3-butoxypropyl-[[2-(p-tolylmethoxy)phenyl]methyl]ammonium CAS Name: 3-butoxypropyl-[[2-[(4-methylphenyl)methoxy]phenyl]methyl]ammonium IUPAC Name: 3-butoxypropyl-[[2-[(4-methylphenyl)methoxy]phenyl]methyl]azanium Traditional Name: 3-butoxypropyl-[2-(4-methylbenzyl)oxybenzyl]ammonium Formula: C22H32NO2+ MolecularWeight: 342.49498

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOCCC[NH2+]CC1=CC=CC=C1OCC2=CC=C(C=C2)C

Isomeric SMILES

CCCCOCCC[NH2+]CC1=CC=CC=C1OCC2=CC=C(C=C2)C

InChI

InChI=1S/C22H31NO2/c1-3-4-15-24-16-7-14-23-17-21-8-5-6-9-22(21)25-18-20-12-10-19(2)11-13-20/h5-6,8-13,23H,3-4,7,14-18H2,1-2H3/p+1