2-phenyl-2-[4-[4-(2-piperidin-4-ylethyl)piperazin-1-yl]phenoxy]ethanoic acid dihydrochloride

Systemtic Name: 2-phenyl-2-[4-[4-(2-piperidin-4-ylethyl)piperazin-1-yl]phenoxy]ethanoic acid dihydrochloride Openeye Name: 2-phenyl-2-[4-[4-[2-(4-piperidyl)ethyl]piperazin-1-yl]phenoxy]acetic acid dihydrochloride CAS Name: 2-phenyl-2-[4-[4-[2-(4-piperidinyl)ethyl]-1-piperazinyl]phenoxy]acetic acid dihydrochloride IUPAC Name: 2-phenyl-2-[4-[4-(2-piperidin-4-ylethyl)piperazin-1-yl]phenoxy]acetic acid dihydrochloride Traditional Name: 2-phenyl-2-[4-[4-[2-(4-piperidyl)ethyl]piperazino]phenoxy]acetic acid dihydrochloride Formula: C25H35Cl2N3O3 MolecularWeight: 496.4697

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1CCN2CCN(CC2)C3=CC=C(C=C3)OC(C4=CC=CC=C4)C(=O)O.Cl.Cl

Isomeric SMILES

C1CNCCC1CCN2CCN(CC2)C3=CC=C(C=C3)OC(C4=CC=CC=C4)C(=O)O.Cl.Cl

InChI

InChI=1S/C25H33N3O3.2ClH/c29-25(30)24(21-4-2-1-3-5-21)31-23-8-6-22(7-9-23)28-18-16-27(17-19-28)15-12-20-10-13-26-14-11-20;;/h1-9,20,24,26H,10-19H2,(H,29,30);2*1H