[5-chloranyl-2-[(4-fluorophenyl)methoxy]phenyl]methyl-(3-methoxypropyl)azanium

Systemtic Name: [5-chloranyl-2-[(4-fluorophenyl)methoxy]phenyl]methyl-(3-methoxypropyl)azanium Openeye Name: [5-chloro-2-[(4-fluorophenyl)methoxy]phenyl]methyl-(3-methoxypropyl)ammonium CAS Name: [5-chloro-2-[(4-fluorophenyl)methoxy]phenyl]methyl-(3-methoxypropyl)ammonium IUPAC Name: [5-chloro-2-[(4-fluorophenyl)methoxy]phenyl]methyl-(3-methoxypropyl)azanium Traditional Name: [5-chloro-2-(4-fluorobenzyl)oxy-benzyl]-(3-methoxypropyl)ammonium Formula: C18H22ClFNO2+ MolecularWeight: 338.824183

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Descriptors Computed from Structure

Canonical SMILES:

COCCC[NH2+]CC1=C(C=CC(=C1)Cl)OCC2=CC=C(C=C2)F

Isomeric SMILES

COCCC[NH2+]CC1=C(C=CC(=C1)Cl)OCC2=CC=C(C=C2)F

InChI

InChI=1S/C18H21ClFNO2/c1-22-10-2-9-21-12-15-11-16(19)5-8-18(15)23-13-14-3-6-17(20)7-4-14/h3-8,11,21H,2,9-10,12-13H2,1H3/p+1