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(6-methoxy-1,3-benzodioxol-5-yl)methyl-(pyridin-3-ylmethyl)-(thiophen-2-ylmethyl)azanium

(6-methoxy-1,3-benzodioxol-5-yl)methyl-(pyridin-3-ylmethyl)-(thiophen-2-ylmethyl)azanium

Systemtic Name:(6-methoxy-1,3-benzodioxol-5-yl)methyl-(pyridin-3-ylmethyl)-(thiophen-2-ylmethyl)azanium
Openeye Name:(6-methoxy-1,3-benzodioxol-5-yl)methyl-(3-pyridylmethyl)-(2-thienylmethyl)ammonium
CAS Name:(6-methoxy-1,3-benzodioxol-5-yl)methyl-(3-pyridinylmethyl)-(thiophen-2-ylmethyl)ammonium
IUPAC Name:(6-methoxy-1,3-benzodioxol-5-yl)methyl-(pyridin-3-ylmethyl)-(thiophen-2-ylmethyl)azanium
Traditional Name:(6-methoxy-1,3-benzodioxol-5-yl)methyl-(3-pyridylmethyl)-(2-thenyl)ammonium
Formula: C20H21N2O3S+
MolecularWeight: 369.45734
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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1C[NH+](CC3=CN=CC=C3)CC4=CC=CS4)OCO2


Isomeric SMILES

COC1=CC2=C(C=C1C[NH+](CC3=CN=CC=C3)CC4=CC=CS4)OCO2


InChI

InChI=1S/C20H20N2O3S/c1-23-18-9-20-19(24-14-25-20)8-16(18)12-22(13-17-5-3-7-26-17)11-15-4-2-6-21-10-15/h2-10H,11-14H2,1H3/p+1


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