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

Systemtic Name: methyl 3-(2-chloranyl-4-fluoranyl-phenyl)-2-[3-(6-propan-2-ylquinolin-8-yl)phenyl]propanoate Openeye Name: methyl 3-(2-chloro-4-fluoro-phenyl)-2-[3-(6-isopropyl-8-quinolyl)phenyl]propanoate CAS Name: 3-(2-chloro-4-fluorophenyl)-2-[3-(6-propan-2-yl-8-quinolinyl)phenyl]propanoic acid methyl ester IUPAC Name: methyl 3-(2-chloro-4-fluorophenyl)-2-[3-(6-propan-2-ylquinolin-8-yl)phenyl]propanoate Traditional Name: 3-(2-chloro-4-fluoro-phenyl)-2-[3-(6-isopropyl-8-quinolyl)phenyl]propionic acid methyl ester Formula: C28H25ClFNO2 MolecularWeight: 461.955003

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H25ClFNO2/c1-17(2)22-13-21-8-5-11-31-27(21)24(15-22)18-6-4-7-19(12-18)25(28(32)33-3)14-20-9-10-23(30)16-26(20)29/h4-13,15-17,25H,14H2,1-3H3