2-methyl-2-[4-[3-[6-(2-methylsulfonylpropan-2-yl)quinolin-8-yl]phenyl]phenyl]propanoic acid

Systemtic Name: 2-methyl-2-[4-[3-[6-(2-methylsulfonylpropan-2-yl)quinolin-8-yl]phenyl]phenyl]propanoic acid Openeye Name: 2-methyl-2-[4-[3-[6-(1-methyl-1-methylsulfonyl-ethyl)-8-quinolyl]phenyl]phenyl]propanoic acid CAS Name: 2-methyl-2-[4-[3-[6-(2-methylsulfonylpropan-2-yl)-8-quinolinyl]phenyl]phenyl]propanoic acid IUPAC Name: 2-methyl-2-[4-[3-[6-(2-methylsulfonylpropan-2-yl)quinolin-8-yl]phenyl]phenyl]propanoic acid Traditional Name: 2-[4-[3-[6-(1-mesyl-1-methyl-ethyl)-8-quinolyl]phenyl]phenyl]-2-methyl-propionic acid Formula: C29H29NO4S MolecularWeight: 487.60986

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1=CC=C(C=C1)C2=CC(=CC=C2)C3=C4C(=CC(=C3)C(C)(C)S(=O)(=O)C)C=CC=N4)C(=O)O

Isomeric SMILES

CC(C)(C1=CC=C(C=C1)C2=CC(=CC=C2)C3=C4C(=CC(=C3)C(C)(C)S(=O)(=O)C)C=CC=N4)C(=O)O

InChI

InChI=1S/C29H29NO4S/c1-28(2,27(31)32)23-13-11-19(12-14-23)20-8-6-9-21(16-20)25-18-24(29(3,4)35(5,33)34)17-22-10-7-15-30-26(22)25/h6-18H,1-5H3,(H,31,32)