N,N'-bis[2-(3,4-dimethoxyphenyl)ethyl]octane-1,8-diamine dihydrobromide

Systemtic Name: N,N'-bis[2-(3,4-dimethoxyphenyl)ethyl]octane-1,8-diamine dihydrobromide Openeye Name: N,N'-bis[2-(3,4-dimethoxyphenyl)ethyl]octane-1,8-diamine dihydrobromide CAS Name: N,N'-bis[2-(3,4-dimethoxyphenyl)ethyl]octane-1,8-diamine dihydrobromide IUPAC Name: N,N'-bis[2-(3,4-dimethoxyphenyl)ethyl]octane-1,8-diamine dihydrobromide Traditional Name: homoveratryl-[8-(homoveratrylamino)octyl]amine dihydrobromide Formula: C28H46Br2N2O4 MolecularWeight: 634.48384

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNCCCCCCCCNCCC2=CC(=C(C=C2)OC)OC)OC.Br.Br

Isomeric SMILES

COC1=C(C=C(C=C1)CCNCCCCCCCCNCCC2=CC(=C(C=C2)OC)OC)OC.Br.Br

InChI

InChI=1S/C28H44N2O4.2BrH/c1-31-25-13-11-23(21-27(25)33-3)15-19-29-17-9-7-5-6-8-10-18-30-20-16-24-12-14-26(32-2)28(22-24)34-4;;/h11-14,21-22,29-30H,5-10,15-20H2,1-4H3;2*1H