dimethyl 2-[4-[4-(2-piperidin-4-ylethyl)piperazin-1-yl]phenoxy]butanedioate dihydrochloride

Systemtic Name: dimethyl 2-[4-[4-(2-piperidin-4-ylethyl)piperazin-1-yl]phenoxy]butanedioate dihydrochloride Openeye Name: dimethyl 2-[4-[4-[2-(4-piperidyl)ethyl]piperazin-1-yl]phenoxy]butanedioate dihydrochloride CAS Name: 2-[4-[4-[2-(4-piperidinyl)ethyl]-1-piperazinyl]phenoxy]butanedioic acid dimethyl ester dihydrochloride IUPAC Name: dimethyl 2-[4-[4-(2-piperidin-4-ylethyl)piperazin-1-yl]phenoxy]butanedioate dihydrochloride Traditional Name: 2-[4-[4-[2-(4-piperidyl)ethyl]piperazino]phenoxy]succinic acid dimethyl ester dihydrochloride Formula: C23H37Cl2N3O5 MolecularWeight: 506.46298

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(C(=O)OC)OC1=CC=C(C=C1)N2CCN(CC2)CCC3CCNCC3.Cl.Cl

Isomeric SMILES

COC(=O)CC(C(=O)OC)OC1=CC=C(C=C1)N2CCN(CC2)CCC3CCNCC3.Cl.Cl

InChI

InChI=1S/C23H35N3O5.2ClH/c1-29-22(27)17-21(23(28)30-2)31-20-5-3-19(4-6-20)26-15-13-25(14-16-26)12-9-18-7-10-24-11-8-18;;/h3-6,18,21,24H,7-17H2,1-2H3;2*1H