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2-(3,4-dimethoxyphenyl)ethyl-methyl-[3-oxidanylidene-3-(phenethylamino)propyl]azanium chloride

2-(3,4-dimethoxyphenyl)ethyl-methyl-[3-oxidanylidene-3-(phenethylamino)propyl]azanium chloride

Systemtic Name:2-(3,4-dimethoxyphenyl)ethyl-methyl-[3-oxidanylidene-3-(phenethylamino)propyl]azanium chloride
Openeye Name:2-(3,4-dimethoxyphenyl)ethyl-methyl-[3-oxo-3-(phenethylamino)propyl]ammonium chloride
CAS Name:2-(3,4-dimethoxyphenyl)ethyl-methyl-[3-oxo-3-(phenethylamino)propyl]ammonium chloride
IUPAC Name:2-(3,4-dimethoxyphenyl)ethyl-methyl-[3-oxo-3-(phenethylamino)propyl]azanium chloride
Traditional Name:homoveratryl-[3-keto-3-(phenethylamino)propyl]-methyl-ammonium chloride
Formula: C22H31ClN2O3
MolecularWeight: 406.94614
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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CCC1=CC(=C(C=C1)OC)OC)CCC(=O)NCCC2=CC=CC=C2.[Cl-]


Isomeric SMILES

C[NH+](CCC1=CC(=C(C=C1)OC)OC)CCC(=O)NCCC2=CC=CC=C2.[Cl-]


InChI

InChI=1S/C22H30N2O3.ClH/c1-24(15-12-19-9-10-20(26-2)21(17-19)27-3)16-13-22(25)23-14-11-18-7-5-4-6-8-18;/h4-10,17H,11-16H2,1-3H3,(H,23,25);1H


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