ethanoyl 2-[4-(2-oxidanylidene-4-piperidin-4-yl-piperazin-1-yl)phenoxy]hexanoate dihydrochloride

Systemtic Name: ethanoyl 2-[4-(2-oxidanylidene-4-piperidin-4-yl-piperazin-1-yl)phenoxy]hexanoate dihydrochloride Openeye Name: acetyl 2-[4-[2-oxo-4-(4-piperidyl)piperazin-1-yl]phenoxy]hexanoate dihydrochloride CAS Name: 2-[4-[2-oxo-4-(4-piperidinyl)-1-piperazinyl]phenoxy]hexanoic acid acetyl ester dihydrochloride IUPAC Name: acetyl 2-[4-(2-oxo-4-piperidin-4-ylpiperazin-1-yl)phenoxy]hexanoate dihydrochloride Traditional Name: 2-[4-[2-keto-4-(4-piperidyl)piperazino]phenoxy]hexanoic acid acetyl ester dihydrochloride Formula: C23H35Cl2N3O5 MolecularWeight: 504.4471

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)OC(=O)C)OC1=CC=C(C=C1)N2CCN(CC2=O)C3CCNCC3.Cl.Cl

Isomeric SMILES

CCCCC(C(=O)OC(=O)C)OC1=CC=C(C=C1)N2CCN(CC2=O)C3CCNCC3.Cl.Cl

InChI

InChI=1S/C23H33N3O5.2ClH/c1-3-4-5-21(23(29)30-17(2)27)31-20-8-6-19(7-9-20)26-15-14-25(16-22(26)28)18-10-12-24-13-11-18;;/h6-9,18,21,24H,3-5,10-16H2,1-2H3;2*1H