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

Systemtic Name: 3-butoxypropyl-[[2-[(4-chlorophenyl)methoxy]phenyl]methyl]azanium Openeye Name: 3-butoxypropyl-[[2-[(4-chlorophenyl)methoxy]phenyl]methyl]ammonium CAS Name: 3-butoxypropyl-[[2-[(4-chlorophenyl)methoxy]phenyl]methyl]ammonium IUPAC Name: 3-butoxypropyl-[[2-[(4-chlorophenyl)methoxy]phenyl]methyl]azanium Traditional Name: 3-butoxypropyl-[2-(4-chlorobenzyl)oxybenzyl]ammonium Formula: C21H29ClNO2+ MolecularWeight: 362.91346

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H28ClNO2/c1-2-3-14-24-15-6-13-23-16-19-7-4-5-8-21(19)25-17-18-9-11-20(22)12-10-18/h4-5,7-12,23H,2-3,6,13-17H2,1H3/p+1