[2-oxidanylidene-2-(1-phenylethylamino)ethyl] 2-[4-[bis(fluoranyl)methoxy]phenyl]quinoline-4-carboxylate

Systemtic Name: [2-oxidanylidene-2-(1-phenylethylamino)ethyl] 2-[4-[bis(fluoranyl)methoxy]phenyl]quinoline-4-carboxylate Openeye Name: [2-oxo-2-(1-phenylethylamino)ethyl] 2-[4-(difluoromethoxy)phenyl]quinoline-4-carboxylate CAS Name: 2-[4-(difluoromethoxy)phenyl]-4-quinolinecarboxylic acid [2-oxo-2-(1-phenylethylamino)ethyl] ester IUPAC Name: [2-oxo-2-(1-phenylethylamino)ethyl] 2-[4-(difluoromethoxy)phenyl]quinoline-4-carboxylate Traditional Name: 2-[4-(difluoromethoxy)phenyl]cinchoninic acid [2-keto-2-(1-phenylethylamino)ethyl] ester Formula: C27H22F2N2O4 MolecularWeight: 476.471386

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC(=O)COC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=C(C=C4)OC(F)F

Isomeric SMILES

CC(C1=CC=CC=C1)NC(=O)COC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=C(C=C4)OC(F)F

InChI

InChI=1S/C27H22F2N2O4/c1-17(18-7-3-2-4-8-18)30-25(32)16-34-26(33)22-15-24(31-23-10-6-5-9-21(22)23)19-11-13-20(14-12-19)35-27(28)29/h2-15,17,27H,16H2,1H3,(H,30,32)