2-(4-methylsulfonylphenyl)-3-[3-[6-(2-methylsulfonylpropan-2-yl)quinolin-8-yl]phenyl]propan-1-ol

Systemtic Name: 2-(4-methylsulfonylphenyl)-3-[3-[6-(2-methylsulfonylpropan-2-yl)quinolin-8-yl]phenyl]propan-1-ol Openeye Name: 3-[3-[6-(1-methyl-1-methylsulfonyl-ethyl)-8-quinolyl]phenyl]-2-(4-methylsulfonylphenyl)propan-1-ol CAS Name: 2-(4-methylsulfonylphenyl)-3-[3-[6-(2-methylsulfonylpropan-2-yl)-8-quinolinyl]phenyl]-1-propanol IUPAC Name: 2-(4-methylsulfonylphenyl)-3-[3-[6-(2-methylsulfonylpropan-2-yl)quinolin-8-yl]phenyl]propan-1-ol Traditional Name: 3-[3-[6-(1-mesyl-1-methyl-ethyl)-8-quinolyl]phenyl]-2-(4-mesylphenyl)propan-1-ol Formula: C29H31NO5S2 MolecularWeight: 537.69014

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1=CC(=C2C(=C1)C=CC=N2)C3=CC(=CC=C3)CC(CO)C4=CC=C(C=C4)S(=O)(=O)C)S(=O)(=O)C

Isomeric SMILES

CC(C)(C1=CC(=C2C(=C1)C=CC=N2)C3=CC(=CC=C3)CC(CO)C4=CC=C(C=C4)S(=O)(=O)C)S(=O)(=O)C

InChI

InChI=1S/C29H31NO5S2/c1-29(2,37(4,34)35)25-17-23-9-6-14-30-28(23)27(18-25)22-8-5-7-20(15-22)16-24(19-31)21-10-12-26(13-11-21)36(3,32)33/h5-15,17-18,24,31H,16,19H2,1-4H3