6-chloranyl-3-oxidanylidene-2-[1-(phenylmethyl)piperidin-4-yl]-1H-isoindole-5-sulfonamide

Systemtic Name: 6-chloranyl-3-oxidanylidene-2-[1-(phenylmethyl)piperidin-4-yl]-1H-isoindole-5-sulfonamide Openeye Name: 2-(1-benzyl-4-piperidyl)-6-chloro-3-oxo-isoindoline-5-sulfonamide CAS Name: 6-chloro-3-oxo-2-[1-(phenylmethyl)-4-piperidinyl]-1H-isoindole-5-sulfonamide IUPAC Name: 2-(1-benzylpiperidin-4-yl)-6-chloro-3-oxo-1H-isoindole-5-sulfonamide Traditional Name: 2-(1-benzyl-4-piperidyl)-6-chloro-3-keto-isoindoline-5-sulfonamide Formula: C20H22ClN3O3S MolecularWeight: 419.92498

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1N2CC3=CC(=C(C=C3C2=O)S(=O)(=O)N)Cl)CC4=CC=CC=C4

Isomeric SMILES

C1CN(CCC1N2CC3=CC(=C(C=C3C2=O)S(=O)(=O)N)Cl)CC4=CC=CC=C4

InChI

InChI=1S/C20H22ClN3O3S/c21-18-10-15-13-24(20(25)17(15)11-19(18)28(22,26)27)16-6-8-23(9-7-16)12-14-4-2-1-3-5-14/h1-5,10-11,16H,6-9,12-13H2,(H2,22,26,27)