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

Systemtic Name: 3-butoxypropyl-[[2-[(2,4-dichlorophenyl)methoxy]phenyl]methyl]azanium Openeye Name: 3-butoxypropyl-[[2-[(2,4-dichlorophenyl)methoxy]phenyl]methyl]ammonium CAS Name: 3-butoxypropyl-[[2-[(2,4-dichlorophenyl)methoxy]phenyl]methyl]ammonium IUPAC Name: 3-butoxypropyl-[[2-[(2,4-dichlorophenyl)methoxy]phenyl]methyl]azanium Traditional Name: 3-butoxypropyl-[2-(2,4-dichlorobenzyl)oxybenzyl]ammonium Formula: C21H28Cl2NO2+ MolecularWeight: 397.35852

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H27Cl2NO2/c1-2-3-12-25-13-6-11-24-15-17-7-4-5-8-21(17)26-16-18-9-10-19(22)14-20(18)23/h4-5,7-10,14,24H,2-3,6,11-13,15-16H2,1H3/p+1