[2-(1,3-benzodioxol-5-ylmethylamino)-2-oxidanylidene-ethyl]-[(2,4-dimethoxyphenyl)methyl]-methyl-azanium

Systemtic Name: [2-(1,3-benzodioxol-5-ylmethylamino)-2-oxidanylidene-ethyl]-[(2,4-dimethoxyphenyl)methyl]-methyl-azanium Openeye Name: [2-(1,3-benzodioxol-5-ylmethylamino)-2-oxo-ethyl]-[(2,4-dimethoxyphenyl)methyl]-methyl-ammonium CAS Name: [2-(1,3-benzodioxol-5-ylmethylamino)-2-oxoethyl]-[(2,4-dimethoxyphenyl)methyl]-methylammonium IUPAC Name: [2-(1,3-benzodioxol-5-ylmethylamino)-2-oxoethyl]-[(2,4-dimethoxyphenyl)methyl]-methylazanium Traditional Name: (2,4-dimethoxybenzyl)-[2-keto-2-(piperonylamino)ethyl]-methyl-ammonium Formula: C20H25N2O5+ MolecularWeight: 373.4229

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=C(C=C(C=C1)OC)OC)CC(=O)NCC2=CC3=C(C=C2)OCO3

Isomeric SMILES

C[NH+](CC1=C(C=C(C=C1)OC)OC)CC(=O)NCC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C20H24N2O5/c1-22(11-15-5-6-16(24-2)9-18(15)25-3)12-20(23)21-10-14-4-7-17-19(8-14)27-13-26-17/h4-9H,10-13H2,1-3H3,(H,21,23)/p+1