ethyl 7-[6-[(4-heptylpiperazin-1-yl)methyl]-2,3-dimethoxy-phenoxy]heptanoate dihydrochloride

Systemtic Name: ethyl 7-[6-[(4-heptylpiperazin-1-yl)methyl]-2,3-dimethoxy-phenoxy]heptanoate dihydrochloride Openeye Name: ethyl 7-[6-[(4-heptylpiperazin-1-yl)methyl]-2,3-dimethoxy-phenoxy]heptanoate dihydrochloride CAS Name: 7-[6-[(4-heptyl-1-piperazinyl)methyl]-2,3-dimethoxyphenoxy]heptanoic acid ethyl ester dihydrochloride IUPAC Name: ethyl 7-[6-[(4-heptylpiperazin-1-yl)methyl]-2,3-dimethoxyphenoxy]heptanoate dihydrochloride Traditional Name: 7-[6-[(4-heptylpiperazino)methyl]-2,3-dimethoxy-phenoxy]enanthic acid ethyl ester dihydrochloride Formula: C29H52Cl2N2O5 MolecularWeight: 579.63958

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCN1CCN(CC1)CC2=C(C(=C(C=C2)OC)OC)OCCCCCCC(=O)OCC.Cl.Cl

Isomeric SMILES

CCCCCCCN1CCN(CC1)CC2=C(C(=C(C=C2)OC)OC)OCCCCCCC(=O)OCC.Cl.Cl

InChI

InChI=1S/C29H50N2O5.2ClH/c1-5-7-8-10-13-18-30-19-21-31(22-20-30)24-25-16-17-26(33-3)29(34-4)28(25)36-23-14-11-9-12-15-27(32)35-6-2;;/h16-17H,5-15,18-24H2,1-4H3;2*1H