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2,3-dihydro-1,4-benzodioxin-6-ylmethyl(3-piperidin-1-ium-1-ylpropyl)azanium

2,3-dihydro-1,4-benzodioxin-6-ylmethyl(3-piperidin-1-ium-1-ylpropyl)azanium

Systemtic Name:2,3-dihydro-1,4-benzodioxin-6-ylmethyl(3-piperidin-1-ium-1-ylpropyl)azanium
Openeye Name:2,3-dihydro-1,4-benzodioxin-6-ylmethyl(3-piperidin-1-ium-1-ylpropyl)ammonium
CAS Name:2,3-dihydro-1,4-benzodioxin-6-ylmethyl-[3-(1-piperidin-1-iumyl)propyl]ammonium
IUPAC Name:2,3-dihydro-1,4-benzodioxin-6-ylmethyl(3-piperidin-1-ium-1-ylpropyl)azanium
Traditional Name:2,3-dihydro-1,4-benzodioxin-6-ylmethyl(3-piperidin-1-ium-1-ylpropyl)ammonium
Formula: C17H28N2O2+2
MolecularWeight: 292.41642
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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CCC[NH2+]CC2=CC3=C(C=C2)OCCO3


Isomeric SMILES

C1CC[NH+](CC1)CCC[NH2+]CC2=CC3=C(C=C2)OCCO3


InChI

InChI=1S/C17H26N2O2/c1-2-8-19(9-3-1)10-4-7-18-14-15-5-6-16-17(13-15)21-12-11-20-16/h5-6,13,18H,1-4,7-12,14H2/p+2


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