3-[1-(1-benzofuran-2-ylmethyl)piperidin-4-yl]-2-methyl-3H-isoindol-1-one hydrochloride

Systemtic Name: 3-[1-(1-benzofuran-2-ylmethyl)piperidin-4-yl]-2-methyl-3H-isoindol-1-one hydrochloride Openeye Name: 3-[1-(benzofuran-2-ylmethyl)-4-piperidyl]-2-methyl-isoindolin-1-one hydrochloride CAS Name: 3-[1-(2-benzofuranylmethyl)-4-piperidinyl]-2-methyl-3H-isoindol-1-one hydrochloride IUPAC Name: 3-[1-(1-benzofuran-2-ylmethyl)piperidin-4-yl]-2-methyl-3H-isoindol-1-one hydrochloride Traditional Name: 3-[1-(benzofuran-2-ylmethyl)-4-piperidyl]-2-methyl-isoindolin-1-one hydrochloride Formula: C23H25ClN2O2 MolecularWeight: 396.9098

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(C2=CC=CC=C2C1=O)C3CCN(CC3)CC4=CC5=CC=CC=C5O4.Cl

Isomeric SMILES

CN1C(C2=CC=CC=C2C1=O)C3CCN(CC3)CC4=CC5=CC=CC=C5O4.Cl

InChI

InChI=1S/C23H24N2O2.ClH/c1-24-22(19-7-3-4-8-20(19)23(24)26)16-10-12-25(13-11-16)15-18-14-17-6-2-5-9-21(17)27-18;/h2-9,14,16,22H,10-13,15H2,1H3;1H