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1,3-benzodioxol-5-ylmethyl(4-oxidanylbutyl)azanium

1,3-benzodioxol-5-ylmethyl(4-oxidanylbutyl)azanium

Systemtic Name:1,3-benzodioxol-5-ylmethyl(4-oxidanylbutyl)azanium
Openeye Name:1,3-benzodioxol-5-ylmethyl(4-hydroxybutyl)ammonium
CAS Name:1,3-benzodioxol-5-ylmethyl(4-hydroxybutyl)ammonium
IUPAC Name:1,3-benzodioxol-5-ylmethyl(4-hydroxybutyl)azanium
Traditional Name:4-hydroxybutyl(piperonyl)ammonium
Formula: C12H18NO3+
MolecularWeight: 224.27622
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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C[NH2+]CCCCO


Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C[NH2+]CCCCO


InChI

InChI=1S/C12H17NO3/c14-6-2-1-5-13-8-10-3-4-11-12(7-10)16-9-15-11/h3-4,7,13-14H,1-2,5-6,8-9H2/p+1


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