3-[2-(2-methoxyphenyl)ethyl]-2-methyl-3-piperidin-4-yl-isoindol-1-one hydrochloride

Systemtic Name: 3-[2-(2-methoxyphenyl)ethyl]-2-methyl-3-piperidin-4-yl-isoindol-1-one hydrochloride Openeye Name: 3-[2-(2-methoxyphenyl)ethyl]-2-methyl-3-(4-piperidyl)isoindolin-1-one hydrochloride CAS Name: 3-[2-(2-methoxyphenyl)ethyl]-2-methyl-3-(4-piperidinyl)-1-isoindolone hydrochloride IUPAC Name: 3-[2-(2-methoxyphenyl)ethyl]-2-methyl-3-piperidin-4-ylisoindol-1-one hydrochloride Traditional Name: 3-[2-(2-methoxyphenyl)ethyl]-2-methyl-3-(4-piperidyl)isoindolin-1-one hydrochloride Formula: C23H29ClN2O2 MolecularWeight: 400.94156

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=CC=CC=C2C1(CCC3=CC=CC=C3OC)C4CCNCC4.Cl

Isomeric SMILES

CN1C(=O)C2=CC=CC=C2C1(CCC3=CC=CC=C3OC)C4CCNCC4.Cl

InChI

InChI=1S/C23H28N2O2.ClH/c1-25-22(26)19-8-4-5-9-20(19)23(25,18-12-15-24-16-13-18)14-11-17-7-3-6-10-21(17)27-2;/h3-10,18,24H,11-16H2,1-2H3;1H