3-[4-(phenylsulfonyl)piperidin-1-yl]carbonyl-6,7-dihydro-5H-1-benzofuran-4-one

Systemtic Name: 3-[4-(phenylsulfonyl)piperidin-1-yl]carbonyl-6,7-dihydro-5H-1-benzofuran-4-one Openeye Name: 3-[4-(benzenesulfonyl)piperidine-1-carbonyl]-6,7-dihydro-5H-benzofuran-4-one CAS Name: 3-[[4-(benzenesulfonyl)-1-piperidinyl]-oxomethyl]-6,7-dihydro-5H-benzofuran-4-one IUPAC Name: 3-[4-(benzenesulfonyl)piperidine-1-carbonyl]-6,7-dihydro-5H-1-benzofuran-4-one Traditional Name: 3-(4-besylpiperidine-1-carbonyl)-6,7-dihydro-5H-benzofuran-4-one Formula: C20H21NO5S MolecularWeight: 387.44944

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C(=O)C1)C(=CO2)C(=O)N3CCC(CC3)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C1CC2=C(C(=O)C1)C(=CO2)C(=O)N3CCC(CC3)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C20H21NO5S/c22-17-7-4-8-18-19(17)16(13-26-18)20(23)21-11-9-15(10-12-21)27(24,25)14-5-2-1-3-6-14/h1-3,5-6,13,15H,4,7-12H2