[2-(1,3-benzodioxol-5-ylmethoxy)phenyl]methyl-(2-hydroxyethyl)-(pyridin-3-ylmethyl)azanium

Systemtic Name: [2-(1,3-benzodioxol-5-ylmethoxy)phenyl]methyl-(2-hydroxyethyl)-(pyridin-3-ylmethyl)azanium Openeye Name: [2-(1,3-benzodioxol-5-ylmethoxy)phenyl]methyl-(2-hydroxyethyl)-(3-pyridylmethyl)ammonium CAS Name: [2-(1,3-benzodioxol-5-ylmethoxy)phenyl]methyl-(2-hydroxyethyl)-(3-pyridinylmethyl)ammonium IUPAC Name: [2-(1,3-benzodioxol-5-ylmethoxy)phenyl]methyl-(2-hydroxyethyl)-(pyridin-3-ylmethyl)azanium Traditional Name: 2-hydroxyethyl-(2-piperonyloxybenzyl)-(3-pyridylmethyl)ammonium Formula: C23H25N2O4+ MolecularWeight: 393.4556

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)COC3=CC=CC=C3C[NH+](CCO)CC4=CN=CC=C4

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)COC3=CC=CC=C3C[NH+](CCO)CC4=CN=CC=C4

InChI

InChI=1S/C23H24N2O4/c26-11-10-25(14-19-4-3-9-24-13-19)15-20-5-1-2-6-21(20)27-16-18-7-8-22-23(12-18)29-17-28-22/h1-9,12-13,26H,10-11,14-17H2/p+1