1-(4-propylphenoxy)-3-(4-pyridin-2-ylpiperazin-1-yl)propan-2-ol hydrochloride

Systemtic Name: 1-(4-propylphenoxy)-3-(4-pyridin-2-ylpiperazin-1-yl)propan-2-ol hydrochloride Openeye Name: 1-(4-propylphenoxy)-3-[4-(2-pyridyl)piperazin-1-yl]propan-2-ol hydrochloride CAS Name: 1-(4-propylphenoxy)-3-[4-(2-pyridinyl)-1-piperazinyl]-2-propanol hydrochloride IUPAC Name: 1-(4-propylphenoxy)-3-(4-pyridin-2-ylpiperazin-1-yl)propan-2-ol hydrochloride Traditional Name: 1-(4-propylphenoxy)-3-[4-(2-pyridyl)piperazino]propan-2-ol hydrochloride Formula: C21H30ClN3O2 MolecularWeight: 391.9348

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)OCC(CN2CCN(CC2)C3=CC=CC=N3)O.Cl

Isomeric SMILES

CCCC1=CC=C(C=C1)OCC(CN2CCN(CC2)C3=CC=CC=N3)O.Cl

InChI

InChI=1S/C21H29N3O2.ClH/c1-2-5-18-7-9-20(10-8-18)26-17-19(25)16-23-12-14-24(15-13-23)21-6-3-4-11-22-21;/h3-4,6-11,19,25H,2,5,12-17H2,1H3;1H