1,3-benzodioxol-5-ylmethyl(2-methylpropyl)azanium

Systemtic Name: 1,3-benzodioxol-5-ylmethyl(2-methylpropyl)azanium Openeye Name: 1,3-benzodioxol-5-ylmethyl(isobutyl)ammonium CAS Name: 1,3-benzodioxol-5-ylmethyl(2-methylpropyl)ammonium IUPAC Name: 1,3-benzodioxol-5-ylmethyl(2-methylpropyl)azanium Traditional Name: isobutyl(piperonyl)ammonium Formula: C12H18NO2+ MolecularWeight: 208.27682

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H17NO2/c1-9(2)6-13-7-10-3-4-11-12(5-10)15-8-14-11/h3-5,9,13H,6-8H2,1-2H3/p+1