methyl 2-methyl-3-(4-methylsulfonylphenyl)-2-[3-(6-propan-2-ylquinolin-8-yl)phenyl]propanoate

Systemtic Name: methyl 2-methyl-3-(4-methylsulfonylphenyl)-2-[3-(6-propan-2-ylquinolin-8-yl)phenyl]propanoate Openeye Name: methyl 2-[3-(6-isopropyl-8-quinolyl)phenyl]-2-methyl-3-(4-methylsulfonylphenyl)propanoate CAS Name: 2-methyl-3-(4-methylsulfonylphenyl)-2-[3-(6-propan-2-yl-8-quinolinyl)phenyl]propanoic acid methyl ester IUPAC Name: methyl 2-methyl-3-(4-methylsulfonylphenyl)-2-[3-(6-propan-2-ylquinolin-8-yl)phenyl]propanoate Traditional Name: 2-[3-(6-isopropyl-8-quinolyl)phenyl]-3-(4-mesylphenyl)-2-methyl-propionic acid methyl ester Formula: C30H31NO4S MolecularWeight: 501.63644

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=C2C(=C1)C=CC=N2)C3=CC(=CC=C3)C(C)(CC4=CC=C(C=C4)S(=O)(=O)C)C(=O)OC

Isomeric SMILES

CC(C)C1=CC(=C2C(=C1)C=CC=N2)C3=CC(=CC=C3)C(C)(CC4=CC=C(C=C4)S(=O)(=O)C)C(=O)OC

InChI

InChI=1S/C30H31NO4S/c1-20(2)24-16-23-9-7-15-31-28(23)27(18-24)22-8-6-10-25(17-22)30(3,29(32)35-4)19-21-11-13-26(14-12-21)36(5,33)34/h6-18,20H,19H2,1-5H3