2-[1-(phenylsulfonyl)piperidin-4-yl]carbonylcyclohexane-1,3-dione

Systemtic Name: 2-[1-(phenylsulfonyl)piperidin-4-yl]carbonylcyclohexane-1,3-dione Openeye Name: 2-[1-(benzenesulfonyl)piperidine-4-carbonyl]cyclohexane-1,3-dione CAS Name: 2-[[1-(benzenesulfonyl)-4-piperidinyl]-oxomethyl]cyclohexane-1,3-dione IUPAC Name: 2-[1-(benzenesulfonyl)piperidine-4-carbonyl]cyclohexane-1,3-dione Traditional Name: 2-(1-besylisonipecotoyl)cyclohexane-1,3-quinone Formula: C18H21NO5S MolecularWeight: 363.42804

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)C(C(=O)C1)C(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

C1CC(=O)C(C(=O)C1)C(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C18H21NO5S/c20-15-7-4-8-16(21)17(15)18(22)13-9-11-19(12-10-13)25(23,24)14-5-2-1-3-6-14/h1-3,5-6,13,17H,4,7-12H2