1-[4-[2-oxidanyl-3-(4-pyridin-2-ylpiperazin-1-yl)propoxy]phenyl]ethanone hydrochloride

Systemtic Name: 1-[4-[2-oxidanyl-3-(4-pyridin-2-ylpiperazin-1-yl)propoxy]phenyl]ethanone hydrochloride Openeye Name: 1-[4-[2-hydroxy-3-[4-(2-pyridyl)piperazin-1-yl]propoxy]phenyl]ethanone hydrochloride CAS Name: 1-[4-[2-hydroxy-3-[4-(2-pyridinyl)-1-piperazinyl]propoxy]phenyl]ethanone hydrochloride IUPAC Name: 1-[4-[2-hydroxy-3-(4-pyridin-2-ylpiperazin-1-yl)propoxy]phenyl]ethanone hydrochloride Traditional Name: 1-[4-[2-hydroxy-3-[4-(2-pyridyl)piperazino]propoxy]phenyl]ethanone hydrochloride Formula: C20H26ClN3O3 MolecularWeight: 391.89174

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)OCC(CN2CCN(CC2)C3=CC=CC=N3)O.Cl

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)OCC(CN2CCN(CC2)C3=CC=CC=N3)O.Cl

InChI

InChI=1S/C20H25N3O3.ClH/c1-16(24)17-5-7-19(8-6-17)26-15-18(25)14-22-10-12-23(13-11-22)20-4-2-3-9-21-20;/h2-9,18,25H,10-15H2,1H3;1H