1,3-benzodioxol-5-ylmethyl-[(2,4,6-trimethylphenyl)methyl]azanium

Systemtic Name: 1,3-benzodioxol-5-ylmethyl-[(2,4,6-trimethylphenyl)methyl]azanium Openeye Name: 1,3-benzodioxol-5-ylmethyl-[(2,4,6-trimethylphenyl)methyl]ammonium CAS Name: 1,3-benzodioxol-5-ylmethyl-[(2,4,6-trimethylphenyl)methyl]ammonium IUPAC Name: 1,3-benzodioxol-5-ylmethyl-[(2,4,6-trimethylphenyl)methyl]azanium Traditional Name: piperonyl-(2,4,6-trimethylbenzyl)ammonium Formula: C18H22NO2+ MolecularWeight: 284.37278

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)C[NH2+]CC2=CC3=C(C=C2)OCO3)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)C[NH2+]CC2=CC3=C(C=C2)OCO3)C

InChI

InChI=1S/C18H21NO2/c1-12-6-13(2)16(14(3)7-12)10-19-9-15-4-5-17-18(8-15)21-11-20-17/h4-8,19H,9-11H2,1-3H3/p+1