methyl 3-[2-[3-[6-(2-methylsulfonylpropan-2-yl)quinolin-8-yl]phenyl]phenyl]propanoate

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1=CC(=C2C(=C1)C=CC=N2)C3=CC=CC(=C3)C4=CC=CC=C4CCC(=O)OC)S(=O)(=O)C

Isomeric SMILES

CC(C)(C1=CC(=C2C(=C1)C=CC=N2)C3=CC=CC(=C3)C4=CC=CC=C4CCC(=O)OC)S(=O)(=O)C

InChI

InChI=1S/C29H29NO4S/c1-29(2,35(4,32)33)24-18-23-12-8-16-30-28(23)26(19-24)22-11-7-10-21(17-22)25-13-6-5-9-20(25)14-15-27(31)34-3/h5-13,16-19H,14-15H2,1-4H3