1,3-benzodioxol-5-ylmethyl-[(3-methylphenyl)methyl]azanium

Systemtic Name: 1,3-benzodioxol-5-ylmethyl-[(3-methylphenyl)methyl]azanium Openeye Name: 1,3-benzodioxol-5-ylmethyl(m-tolylmethyl)ammonium CAS Name: 1,3-benzodioxol-5-ylmethyl-[(3-methylphenyl)methyl]ammonium IUPAC Name: 1,3-benzodioxol-5-ylmethyl-[(3-methylphenyl)methyl]azanium Traditional Name: (3-methylbenzyl)-piperonyl-ammonium Formula: C16H18NO2+ MolecularWeight: 256.31962

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H17NO2/c1-12-3-2-4-13(7-12)9-17-10-14-5-6-15-16(8-14)19-11-18-15/h2-8,17H,9-11H2,1H3/p+1