1-[4-[[3-[6-(2-methylsulfonylpropan-2-yl)quinolin-8-yl]phenyl]methoxy]-2-oxidanyl-3-propyl-phenyl]ethanone

Systemtic Name: 1-[4-[[3-[6-(2-methylsulfonylpropan-2-yl)quinolin-8-yl]phenyl]methoxy]-2-oxidanyl-3-propyl-phenyl]ethanone Openeye Name: 1-[2-hydroxy-4-[[3-[6-(1-methyl-1-methylsulfonyl-ethyl)-8-quinolyl]phenyl]methoxy]-3-propyl-phenyl]ethanone CAS Name: 1-[2-hydroxy-4-[[3-[6-(2-methylsulfonylpropan-2-yl)-8-quinolinyl]phenyl]methoxy]-3-propylphenyl]ethanone IUPAC Name: 1-[2-hydroxy-4-[[3-[6-(2-methylsulfonylpropan-2-yl)quinolin-8-yl]phenyl]methoxy]-3-propylphenyl]ethanone Traditional Name: 1-[2-hydroxy-4-[3-[6-(1-mesyl-1-methyl-ethyl)-8-quinolyl]benzyl]oxy-3-propyl-phenyl]ethanone Formula: C31H33NO5S MolecularWeight: 531.66242

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1O)C(=O)C)OCC2=CC=CC(=C2)C3=C4C(=CC(=C3)C(C)(C)S(=O)(=O)C)C=CC=N4

Isomeric SMILES

CCCC1=C(C=CC(=C1O)C(=O)C)OCC2=CC=CC(=C2)C3=C4C(=CC(=C3)C(C)(C)S(=O)(=O)C)C=CC=N4

InChI

InChI=1S/C31H33NO5S/c1-6-9-26-28(14-13-25(20(2)33)30(26)34)37-19-21-10-7-11-22(16-21)27-18-24(31(3,4)38(5,35)36)17-23-12-8-15-32-29(23)27/h7-8,10-18,34H,6,9,19H2,1-5H3