[2-[2,5-bis(fluoranyl)phenyl]-2-oxidanylidene-ethyl] 2-propan-2-ylquinoline-4-carboxylate

Systemtic Name: [2-[2,5-bis(fluoranyl)phenyl]-2-oxidanylidene-ethyl] 2-propan-2-ylquinoline-4-carboxylate Openeye Name: [2-(2,5-difluorophenyl)-2-oxo-ethyl] 2-isopropylquinoline-4-carboxylate CAS Name: 2-propan-2-yl-4-quinolinecarboxylic acid [2-(2,5-difluorophenyl)-2-oxoethyl] ester IUPAC Name: [2-(2,5-difluorophenyl)-2-oxoethyl] 2-propan-2-ylquinoline-4-carboxylate Traditional Name: 2-isopropylcinchoninic acid [2-(2,5-difluorophenyl)-2-keto-ethyl] ester Formula: C21H17F2NO3 MolecularWeight: 369.361386

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NC2=CC=CC=C2C(=C1)C(=O)OCC(=O)C3=C(C=CC(=C3)F)F

Isomeric SMILES

CC(C)C1=NC2=CC=CC=C2C(=C1)C(=O)OCC(=O)C3=C(C=CC(=C3)F)F

InChI

InChI=1S/C21H17F2NO3/c1-12(2)19-10-15(14-5-3-4-6-18(14)24-19)21(26)27-11-20(25)16-9-13(22)7-8-17(16)23/h3-10,12H,11H2,1-2H3