2-(1,3-benzodioxol-5-yl)ethyl-[(2,4,5-trimethoxyphenyl)methyl]azanium

Systemtic Name: 2-(1,3-benzodioxol-5-yl)ethyl-[(2,4,5-trimethoxyphenyl)methyl]azanium Openeye Name: 2-(1,3-benzodioxol-5-yl)ethyl-[(2,4,5-trimethoxyphenyl)methyl]ammonium CAS Name: 2-(1,3-benzodioxol-5-yl)ethyl-[(2,4,5-trimethoxyphenyl)methyl]ammonium IUPAC Name: 2-(1,3-benzodioxol-5-yl)ethyl-[(2,4,5-trimethoxyphenyl)methyl]azanium Traditional Name: homopiperonyl-(2,4,5-trimethoxybenzyl)ammonium Formula: C19H24NO5+ MolecularWeight: 346.39756

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C[NH2+]CCC2=CC3=C(C=C2)OCO3)OC)OC

Isomeric SMILES

COC1=CC(=C(C=C1C[NH2+]CCC2=CC3=C(C=C2)OCO3)OC)OC

InChI

InChI=1S/C19H23NO5/c1-21-16-10-18(23-3)17(22-2)9-14(16)11-20-7-6-13-4-5-15-19(8-13)25-12-24-15/h4-5,8-10,20H,6-7,11-12H2,1-3H3/p+1