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

Systemtic Name: ethyl 7-[6-[(4-cyclohexylpiperazin-1-yl)methyl]-2,3-dimethoxy-phenoxy]heptanoate dihydrochloride Openeye Name: ethyl 7-[6-[(4-cyclohexylpiperazin-1-yl)methyl]-2,3-dimethoxy-phenoxy]heptanoate dihydrochloride CAS Name: 7-[6-[(4-cyclohexyl-1-piperazinyl)methyl]-2,3-dimethoxyphenoxy]heptanoic acid ethyl ester dihydrochloride IUPAC Name: ethyl 7-[6-[(4-cyclohexylpiperazin-1-yl)methyl]-2,3-dimethoxyphenoxy]heptanoate dihydrochloride Traditional Name: 7-[6-[(4-cyclohexylpiperazino)methyl]-2,3-dimethoxy-phenoxy]enanthic acid ethyl ester dihydrochloride Formula: C28H48Cl2N2O5 MolecularWeight: 563.59712

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCCCCOC1=C(C=CC(=C1OC)OC)CN2CCN(CC2)C3CCCCC3.Cl.Cl

Isomeric SMILES

CCOC(=O)CCCCCCOC1=C(C=CC(=C1OC)OC)CN2CCN(CC2)C3CCCCC3.Cl.Cl

InChI

InChI=1S/C28H46N2O5.2ClH/c1-4-34-26(31)14-10-5-6-11-21-35-27-23(15-16-25(32-2)28(27)33-3)22-29-17-19-30(20-18-29)24-12-8-7-9-13-24;;/h15-16,24H,4-14,17-22H2,1-3H3;2*1H