(4-butoxyphenyl)methyl-[(3-fluorophenyl)methyl]azanium

Systemtic Name: (4-butoxyphenyl)methyl-[(3-fluorophenyl)methyl]azanium Openeye Name: (4-butoxyphenyl)methyl-[(3-fluorophenyl)methyl]ammonium CAS Name: (4-butoxyphenyl)methyl-[(3-fluorophenyl)methyl]ammonium IUPAC Name: (4-butoxyphenyl)methyl-[(3-fluorophenyl)methyl]azanium Traditional Name: (4-butoxybenzyl)-(3-fluorobenzyl)ammonium Formula: C18H23FNO+ MolecularWeight: 288.379723

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C[NH2+]CC2=CC(=CC=C2)F

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C[NH2+]CC2=CC(=CC=C2)F

InChI

InChI=1S/C18H22FNO/c1-2-3-11-21-18-9-7-15(8-10-18)13-20-14-16-5-4-6-17(19)12-16/h4-10,12,20H,2-3,11,13-14H2,1H3/p+1