3-[3-(4-fluoranylphenoxy)propyl]-2-methyl-3-piperidin-4-yl-isoindol-1-one hydrochloride

Systemtic Name: 3-[3-(4-fluoranylphenoxy)propyl]-2-methyl-3-piperidin-4-yl-isoindol-1-one hydrochloride Openeye Name: 3-[3-(4-fluorophenoxy)propyl]-2-methyl-3-(4-piperidyl)isoindolin-1-one hydrochloride CAS Name: 3-[3-(4-fluorophenoxy)propyl]-2-methyl-3-(4-piperidinyl)-1-isoindolone hydrochloride IUPAC Name: 3-[3-(4-fluorophenoxy)propyl]-2-methyl-3-piperidin-4-ylisoindol-1-one hydrochloride Traditional Name: 3-[3-(4-fluorophenoxy)propyl]-2-methyl-3-(4-piperidyl)isoindolin-1-one hydrochloride Formula: C23H28ClFN2O2 MolecularWeight: 418.932023

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=CC=CC=C2C1(CCCOC3=CC=C(C=C3)F)C4CCNCC4.Cl

Isomeric SMILES

CN1C(=O)C2=CC=CC=C2C1(CCCOC3=CC=C(C=C3)F)C4CCNCC4.Cl

InChI

InChI=1S/C23H27FN2O2.ClH/c1-26-22(27)20-5-2-3-6-21(20)23(26,17-11-14-25-15-12-17)13-4-16-28-19-9-7-18(24)8-10-19;/h2-3,5-10,17,25H,4,11-16H2,1H3;1H