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(6-chloranyl-1,3-benzodioxol-5-yl)methyl-[(4-methylphenyl)methyl]-(pyridin-4-ylmethyl)azanium

(6-chloranyl-1,3-benzodioxol-5-yl)methyl-[(4-methylphenyl)methyl]-(pyridin-4-ylmethyl)azanium

Systemtic Name:(6-chloranyl-1,3-benzodioxol-5-yl)methyl-[(4-methylphenyl)methyl]-(pyridin-4-ylmethyl)azanium
Openeye Name:(6-chloro-1,3-benzodioxol-5-yl)methyl-(p-tolylmethyl)-(4-pyridylmethyl)ammonium
CAS Name:(6-chloro-1,3-benzodioxol-5-yl)methyl-[(4-methylphenyl)methyl]-(pyridin-4-ylmethyl)ammonium
IUPAC Name:(6-chloro-1,3-benzodioxol-5-yl)methyl-[(4-methylphenyl)methyl]-(pyridin-4-ylmethyl)azanium
Traditional Name:(6-chloro-1,3-benzodioxol-5-yl)methyl-(4-methylbenzyl)-(4-pyridylmethyl)ammonium
Formula: C22H22ClN2O2+
MolecularWeight: 381.87528
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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C[NH+](CC2=CC=NC=C2)CC3=CC4=C(C=C3Cl)OCO4


Isomeric SMILES

CC1=CC=C(C=C1)C[NH+](CC2=CC=NC=C2)CC3=CC4=C(C=C3Cl)OCO4


InChI

InChI=1S/C22H21ClN2O2/c1-16-2-4-17(5-3-16)12-25(13-18-6-8-24-9-7-18)14-19-10-21-22(11-20(19)23)27-15-26-21/h2-11H,12-15H2,1H3/p+1


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