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1-adamantyl(1,3-benzodioxol-5-ylmethyl)azanium

1-adamantyl(1,3-benzodioxol-5-ylmethyl)azanium

Systemtic Name:1-adamantyl(1,3-benzodioxol-5-ylmethyl)azanium
Openeye Name:1-adamantyl(1,3-benzodioxol-5-ylmethyl)ammonium
CAS Name:1-adamantyl(1,3-benzodioxol-5-ylmethyl)ammonium
IUPAC Name:1-adamantyl(1,3-benzodioxol-5-ylmethyl)azanium
Traditional Name:1-adamantyl(piperonyl)ammonium
Formula: C18H24NO2+
MolecularWeight: 286.38866
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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)[NH2+]CC4=CC5=C(C=C4)OCO5


Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)[NH2+]CC4=CC5=C(C=C4)OCO5


InChI

InChI=1S/C18H23NO2/c1-2-16-17(21-11-20-16)6-12(1)10-19-18-7-13-3-14(8-18)5-15(4-13)9-18/h1-2,6,13-15,19H,3-5,7-11H2/p+1


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