1,3-benzodioxol-5-ylmethyl(heptan-4-yl)azanium

Systemtic Name: 1,3-benzodioxol-5-ylmethyl(heptan-4-yl)azanium Openeye Name: 1,3-benzodioxol-5-ylmethyl(1-propylbutyl)ammonium CAS Name: 1,3-benzodioxol-5-ylmethyl(heptan-4-yl)ammonium IUPAC Name: 1,3-benzodioxol-5-ylmethyl(heptan-4-yl)azanium Traditional Name: piperonyl(1-propylbutyl)ammonium Formula: C15H24NO2+ MolecularWeight: 250.35656

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CCC)[NH2+]CC1=CC2=C(C=C1)OCO2

Isomeric SMILES

CCCC(CCC)[NH2+]CC1=CC2=C(C=C1)OCO2

InChI

InChI=1S/C15H23NO2/c1-3-5-13(6-4-2)16-10-12-7-8-14-15(9-12)18-11-17-14/h7-9,13,16H,3-6,10-11H2,1-2H3/p+1