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2-adamantyl-[2-(1,3-benzodioxol-5-yl)ethyl]azanium

2-adamantyl-[2-(1,3-benzodioxol-5-yl)ethyl]azanium

Systemtic Name:2-adamantyl-[2-(1,3-benzodioxol-5-yl)ethyl]azanium
Openeye Name:2-adamantyl-[2-(1,3-benzodioxol-5-yl)ethyl]ammonium
CAS Name:2-adamantyl-[2-(1,3-benzodioxol-5-yl)ethyl]ammonium
IUPAC Name:2-adamantyl-[2-(1,3-benzodioxol-5-yl)ethyl]azanium
Traditional Name:2-adamantyl(homopiperonyl)ammonium
Formula: C19H26NO2+
MolecularWeight: 300.41524
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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)C3[NH2+]CCC4=CC5=C(C=C4)OCO5


Isomeric SMILES

C1C2CC3CC1CC(C2)C3[NH2+]CCC4=CC5=C(C=C4)OCO5


InChI

InChI=1S/C19H25NO2/c1-2-17-18(22-11-21-17)10-12(1)3-4-20-19-15-6-13-5-14(8-15)9-16(19)7-13/h1-2,10,13-16,19-20H,3-9,11H2/p+1


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