[4-(4-fluorophenyl)-4-oxidanylidene-butyl] 2-phenylquinoline-4-carboxylate

Systemtic Name: [4-(4-fluorophenyl)-4-oxidanylidene-butyl] 2-phenylquinoline-4-carboxylate Openeye Name: [4-(4-fluorophenyl)-4-oxo-butyl] 2-phenylquinoline-4-carboxylate CAS Name: 2-phenyl-4-quinolinecarboxylic acid [4-(4-fluorophenyl)-4-oxobutyl] ester IUPAC Name: [4-(4-fluorophenyl)-4-oxobutyl] 2-phenylquinoline-4-carboxylate Traditional Name: 2-phenylcinchoninic acid [4-(4-fluorophenyl)-4-keto-butyl] ester Formula: C26H20FNO3 MolecularWeight: 413.440303

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)OCCCC(=O)C4=CC=C(C=C4)F

Isomeric SMILES

C1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)OCCCC(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C26H20FNO3/c27-20-14-12-19(13-15-20)25(29)11-6-16-31-26(30)22-17-24(18-7-2-1-3-8-18)28-23-10-5-4-9-21(22)23/h1-5,7-10,12-15,17H,6,11,16H2