1,3-benzodioxol-5-ylmethyl-[[3-(2-methylpropoxy)phenyl]methyl]azanium

Systemtic Name: 1,3-benzodioxol-5-ylmethyl-[[3-(2-methylpropoxy)phenyl]methyl]azanium Openeye Name: 1,3-benzodioxol-5-ylmethyl-[(3-isobutoxyphenyl)methyl]ammonium CAS Name: 1,3-benzodioxol-5-ylmethyl-[[3-(2-methylpropoxy)phenyl]methyl]ammonium IUPAC Name: 1,3-benzodioxol-5-ylmethyl-[[3-(2-methylpropoxy)phenyl]methyl]azanium Traditional Name: (3-isobutoxybenzyl)-piperonyl-ammonium Formula: C19H24NO3+ MolecularWeight: 314.39876

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=CC=CC(=C1)C[NH2+]CC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CC(C)COC1=CC=CC(=C1)C[NH2+]CC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C19H23NO3/c1-14(2)12-21-17-5-3-4-15(8-17)10-20-11-16-6-7-18-19(9-16)23-13-22-18/h3-9,14,20H,10-13H2,1-2H3/p+1