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

Systemtic Name: 3-butoxypropyl-[[2-[(2-fluorophenyl)methoxy]-3-methoxy-phenyl]methyl]azanium Openeye Name: 3-butoxypropyl-[[2-[(2-fluorophenyl)methoxy]-3-methoxy-phenyl]methyl]ammonium CAS Name: 3-butoxypropyl-[[2-[(2-fluorophenyl)methoxy]-3-methoxyphenyl]methyl]ammonium IUPAC Name: 3-butoxypropyl-[[2-[(2-fluorophenyl)methoxy]-3-methoxyphenyl]methyl]azanium Traditional Name: 3-butoxypropyl-[2-(2-fluorobenzyl)oxy-3-methoxy-benzyl]ammonium Formula: C22H31FNO3+ MolecularWeight: 376.484843

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOCCC[NH2+]CC1=C(C(=CC=C1)OC)OCC2=CC=CC=C2F

Isomeric SMILES

CCCCOCCC[NH2+]CC1=C(C(=CC=C1)OC)OCC2=CC=CC=C2F

InChI

InChI=1S/C22H30FNO3/c1-3-4-14-26-15-8-13-24-16-18-10-7-12-21(25-2)22(18)27-17-19-9-5-6-11-20(19)23/h5-7,9-12,24H,3-4,8,13-17H2,1-2H3/p+1