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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CN2CC3=CC=CC=C3C2=O)CC4=CC5=CC=CC=C5O4.Cl

Isomeric SMILES

C1CN(CCC1CN2CC3=CC=CC=C3C2=O)CC4=CC5=CC=CC=C5O4.Cl

InChI

InChI=1S/C23H24N2O2.ClH/c26-23-21-7-3-1-6-19(21)15-25(23)14-17-9-11-24(12-10-17)16-20-13-18-5-2-4-8-22(18)27-20;/h1-8,13,17H,9-12,14-16H2;1H