3-(2-oxidanylidene-2-piperidin-1-yl-ethyl)-2-(phenylsulfonyl)-3H-isoindol-1-one

Systemtic Name: 3-(2-oxidanylidene-2-piperidin-1-yl-ethyl)-2-(phenylsulfonyl)-3H-isoindol-1-one Openeye Name: 2-(benzenesulfonyl)-3-[2-oxo-2-(1-piperidyl)ethyl]isoindolin-1-one CAS Name: 2-(benzenesulfonyl)-3-[2-oxo-2-(1-piperidinyl)ethyl]-3H-isoindol-1-one IUPAC Name: 2-(benzenesulfonyl)-3-(2-oxo-2-piperidin-1-ylethyl)-3H-isoindol-1-one Traditional Name: 2-besyl-3-(2-keto-2-piperidino-ethyl)isoindolin-1-one Formula: C21H22N2O4S MolecularWeight: 398.47538

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)CC2C3=CC=CC=C3C(=O)N2S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C1CCN(CC1)C(=O)CC2C3=CC=CC=C3C(=O)N2S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C21H22N2O4S/c24-20(22-13-7-2-8-14-22)15-19-17-11-5-6-12-18(17)21(25)23(19)28(26,27)16-9-3-1-4-10-16/h1,3-6,9-12,19H,2,7-8,13-15H2