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

Systemtic Name: 2-[[1-(2-oxidanylidene-2-thiophen-2-yl-ethyl)piperidin-4-yl]methyl]-3H-isoindol-1-one hydrochloride Openeye Name: 2-[[1-[2-oxo-2-(2-thienyl)ethyl]-4-piperidyl]methyl]isoindolin-1-one hydrochloride CAS Name: 2-[[1-(2-oxo-2-thiophen-2-ylethyl)-4-piperidinyl]methyl]-3H-isoindol-1-one hydrochloride IUPAC Name: 2-[[1-(2-oxo-2-thiophen-2-ylethyl)piperidin-4-yl]methyl]-3H-isoindol-1-one hydrochloride Traditional Name: 2-[[1-[2-keto-2-(2-thienyl)ethyl]-4-piperidyl]methyl]isoindolin-1-one hydrochloride Formula: C20H23ClN2O2S MolecularWeight: 390.92682

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CN2CC3=CC=CC=C3C2=O)CC(=O)C4=CC=CS4.Cl

Isomeric SMILES

C1CN(CCC1CN2CC3=CC=CC=C3C2=O)CC(=O)C4=CC=CS4.Cl

InChI

InChI=1S/C20H22N2O2S.ClH/c23-18(19-6-3-11-25-19)14-21-9-7-15(8-10-21)12-22-13-16-4-1-2-5-17(16)20(22)24;/h1-6,11,15H,7-10,12-14H2;1H