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

Systemtic Name: cyclohexyl 2-[4-[2-(2-oxidanylidene-4-piperidin-4-yl-piperazin-1-yl)ethanoyl]phenoxy]ethanoate dihydrochloride Openeye Name: cyclohexyl 2-[4-[2-[2-oxo-4-(4-piperidyl)piperazin-1-yl]acetyl]phenoxy]acetate dihydrochloride CAS Name: 2-[4-[1-oxo-2-[2-oxo-4-(4-piperidinyl)-1-piperazinyl]ethyl]phenoxy]acetic acid cyclohexyl ester dihydrochloride IUPAC Name: cyclohexyl 2-[4-[2-(2-oxo-4-piperidin-4-ylpiperazin-1-yl)acetyl]phenoxy]acetate dihydrochloride Traditional Name: 2-[4-[2-[2-keto-4-(4-piperidyl)piperazino]acetyl]phenoxy]acetic acid cyclohexyl ester dihydrochloride Formula: C25H37Cl2N3O5 MolecularWeight: 530.48438

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)OC(=O)COC2=CC=C(C=C2)C(=O)CN3CCN(CC3=O)C4CCNCC4.Cl.Cl

Isomeric SMILES

C1CCC(CC1)OC(=O)COC2=CC=C(C=C2)C(=O)CN3CCN(CC3=O)C4CCNCC4.Cl.Cl

InChI

InChI=1S/C25H35N3O5.2ClH/c29-23(16-28-15-14-27(17-24(28)30)20-10-12-26-13-11-20)19-6-8-21(9-7-19)32-18-25(31)33-22-4-2-1-3-5-22;;/h6-9,20,22,26H,1-5,10-18H2;2*1H