1-[4-[6-(4-methylsulfonylphenyl)-4H-1,3-benzodioxin-2-yl]piperidin-1-yl]propan-1-one

Systemtic Name: 1-[4-[6-(4-methylsulfonylphenyl)-4H-1,3-benzodioxin-2-yl]piperidin-1-yl]propan-1-one Openeye Name: 1-[4-[6-(4-methylsulfonylphenyl)-4H-1,3-benzodioxin-2-yl]-1-piperidyl]propan-1-one CAS Name: 1-[4-[6-(4-methylsulfonylphenyl)-4H-1,3-benzodioxin-2-yl]-1-piperidinyl]-1-propanone IUPAC Name: 1-[4-[6-(4-methylsulfonylphenyl)-4H-1,3-benzodioxin-2-yl]piperidin-1-yl]propan-1-one Traditional Name: 1-[4-[6-(4-mesylphenyl)-4H-1,3-benzodioxin-2-yl]piperidino]propan-1-one Formula: C23H27NO5S MolecularWeight: 429.52918

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N1CCC(CC1)C2OCC3=C(O2)C=CC(=C3)C4=CC=C(C=C4)S(=O)(=O)C

Isomeric SMILES

CCC(=O)N1CCC(CC1)C2OCC3=C(O2)C=CC(=C3)C4=CC=C(C=C4)S(=O)(=O)C

InChI

InChI=1S/C23H27NO5S/c1-3-22(25)24-12-10-17(11-13-24)23-28-15-19-14-18(6-9-21(19)29-23)16-4-7-20(8-5-16)30(2,26)27/h4-9,14,17,23H,3,10-13,15H2,1-2H3