1-[4-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl)piperidin-1-yl]-2-phenyl-2-phenylsulfanyl-ethanone

Systemtic Name: 1-[4-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl)piperidin-1-yl]-2-phenyl-2-phenylsulfanyl-ethanone Openeye Name: 1-[4-(2,3-dihydro-1,4-benzodioxine-6-carbonyl)-1-piperidyl]-2-phenyl-2-phenylsulfanyl-ethanone CAS Name: 1-[4-[2,3-dihydro-1,4-benzodioxin-6-yl(oxo)methyl]-1-piperidinyl]-2-phenyl-2-(phenylthio)ethanone IUPAC Name: 1-[4-(2,3-dihydro-1,4-benzodioxine-6-carbonyl)piperidin-1-yl]-2-phenyl-2-phenylsulfanylethanone Traditional Name: 1-[4-(2,3-dihydro-1,4-benzodioxin-6-carbonyl)piperidino]-2-phenyl-2-(phenylthio)ethanone Formula: C28H27NO4S MolecularWeight: 473.58328

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)C2=CC3=C(C=C2)OCCO3)C(=O)C(C4=CC=CC=C4)SC5=CC=CC=C5

Isomeric SMILES

C1CN(CCC1C(=O)C2=CC3=C(C=C2)OCCO3)C(=O)C(C4=CC=CC=C4)SC5=CC=CC=C5

InChI

InChI=1S/C28H27NO4S/c30-26(22-11-12-24-25(19-22)33-18-17-32-24)20-13-15-29(16-14-20)28(31)27(21-7-3-1-4-8-21)34-23-9-5-2-6-10-23/h1-12,19-20,27H,13-18H2