bis[2-(3,4-dimethoxyphenyl)ethyl]azanium chloride

Systemtic Name: bis[2-(3,4-dimethoxyphenyl)ethyl]azanium chloride Openeye Name: bis[2-(3,4-dimethoxyphenyl)ethyl]ammonium chloride CAS Name: bis[2-(3,4-dimethoxyphenyl)ethyl]ammonium chloride IUPAC Name: bis[2-(3,4-dimethoxyphenyl)ethyl]azanium chloride Traditional Name: dihomoveratrylammonium chloride Formula: C20H28ClNO4 MolecularWeight: 381.89362

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CC[NH2+]CCC2=CC(=C(C=C2)OC)OC)OC.[Cl-]

Isomeric SMILES

COC1=C(C=C(C=C1)CC[NH2+]CCC2=CC(=C(C=C2)OC)OC)OC.[Cl-]

InChI

InChI=1S/C20H27NO4.ClH/c1-22-17-7-5-15(13-19(17)24-3)9-11-21-12-10-16-6-8-18(23-2)20(14-16)25-4;/h5-8,13-14,21H,9-12H2,1-4H3;1H