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2-(3,4-dimethoxyphenyl)ethyl-[(4-fluorophenyl)methyl]-(pyridin-4-ylmethyl)azanium

2-(3,4-dimethoxyphenyl)ethyl-[(4-fluorophenyl)methyl]-(pyridin-4-ylmethyl)azanium

Systemtic Name:2-(3,4-dimethoxyphenyl)ethyl-[(4-fluorophenyl)methyl]-(pyridin-4-ylmethyl)azanium
Openeye Name:2-(3,4-dimethoxyphenyl)ethyl-[(4-fluorophenyl)methyl]-(4-pyridylmethyl)ammonium
CAS Name:2-(3,4-dimethoxyphenyl)ethyl-[(4-fluorophenyl)methyl]-(pyridin-4-ylmethyl)ammonium
IUPAC Name:2-(3,4-dimethoxyphenyl)ethyl-[(4-fluorophenyl)methyl]-(pyridin-4-ylmethyl)azanium
Traditional Name:(4-fluorobenzyl)-homoveratryl-(4-pyridylmethyl)ammonium
Formula: C23H26FN2O2+
MolecularWeight: 381.463143
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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CC[NH+](CC2=CC=C(C=C2)F)CC3=CC=NC=C3)OC


Isomeric SMILES

COC1=C(C=C(C=C1)CC[NH+](CC2=CC=C(C=C2)F)CC3=CC=NC=C3)OC


InChI

InChI=1S/C23H25FN2O2/c1-27-22-8-5-18(15-23(22)28-2)11-14-26(17-20-9-12-25-13-10-20)16-19-3-6-21(24)7-4-19/h3-10,12-13,15H,11,14,16-17H2,1-2H3/p+1


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