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

Systemtic Name: 2-(1,3-benzodioxol-5-yl)ethyl-[(4-ethoxyphenyl)methyl]-(naphthalen-1-ylmethyl)azanium Openeye Name: 2-(1,3-benzodioxol-5-yl)ethyl-[(4-ethoxyphenyl)methyl]-(1-naphthylmethyl)ammonium CAS Name: 2-(1,3-benzodioxol-5-yl)ethyl-[(4-ethoxyphenyl)methyl]-(1-naphthalenylmethyl)ammonium IUPAC Name: 2-(1,3-benzodioxol-5-yl)ethyl-[(4-ethoxyphenyl)methyl]-(naphthalen-1-ylmethyl)azanium Traditional Name: (4-ethoxybenzyl)-homopiperonyl-(1-naphthylmethyl)ammonium Formula: C29H30NO3+ MolecularWeight: 440.5534

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C[NH+](CCC2=CC3=C(C=C2)OCO3)CC4=CC=CC5=CC=CC=C54

Isomeric SMILES

CCOC1=CC=C(C=C1)C[NH+](CCC2=CC3=C(C=C2)OCO3)CC4=CC=CC5=CC=CC=C54

InChI

InChI=1S/C29H29NO3/c1-2-31-26-13-10-23(11-14-26)19-30(17-16-22-12-15-28-29(18-22)33-21-32-28)20-25-8-5-7-24-6-3-4-9-27(24)25/h3-15,18H,2,16-17,19-21H2,1H3/p+1