2-(3,4-dimethoxyphenyl)ethyl-[[3-[(4-methylphenyl)methoxy]phenyl]methyl]azanium

Systemtic Name: 2-(3,4-dimethoxyphenyl)ethyl-[[3-[(4-methylphenyl)methoxy]phenyl]methyl]azanium Openeye Name: 2-(3,4-dimethoxyphenyl)ethyl-[[3-(p-tolylmethoxy)phenyl]methyl]ammonium CAS Name: 2-(3,4-dimethoxyphenyl)ethyl-[[3-[(4-methylphenyl)methoxy]phenyl]methyl]ammonium IUPAC Name: 2-(3,4-dimethoxyphenyl)ethyl-[[3-[(4-methylphenyl)methoxy]phenyl]methyl]azanium Traditional Name: homoveratryl-[3-(4-methylbenzyl)oxybenzyl]ammonium Formula: C25H30NO3+ MolecularWeight: 392.5106

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)COC2=CC=CC(=C2)C[NH2+]CCC3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CC1=CC=C(C=C1)COC2=CC=CC(=C2)C[NH2+]CCC3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C25H29NO3/c1-19-7-9-21(10-8-19)18-29-23-6-4-5-22(15-23)17-26-14-13-20-11-12-24(27-2)25(16-20)28-3/h4-12,15-16,26H,13-14,17-18H2,1-3H3/p+1