[1-[[2,6-bis(fluoranyl)phenyl]amino]-1-oxidanylidene-propan-2-yl] 2-propan-2-ylquinoline-4-carboxylate

Systemtic Name: [1-[[2,6-bis(fluoranyl)phenyl]amino]-1-oxidanylidene-propan-2-yl] 2-propan-2-ylquinoline-4-carboxylate Openeye Name: [2-(2,6-difluoroanilino)-1-methyl-2-oxo-ethyl] 2-isopropylquinoline-4-carboxylate CAS Name: 2-propan-2-yl-4-quinolinecarboxylic acid [1-(2,6-difluoroanilino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(2,6-difluoroanilino)-1-oxopropan-2-yl] 2-propan-2-ylquinoline-4-carboxylate Traditional Name: 2-isopropylcinchoninic acid [2-(2,6-difluoroanilino)-2-keto-1-methyl-ethyl] ester Formula: C22H20F2N2O3 MolecularWeight: 398.402606

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NC2=CC=CC=C2C(=C1)C(=O)OC(C)C(=O)NC3=C(C=CC=C3F)F

Isomeric SMILES

CC(C)C1=NC2=CC=CC=C2C(=C1)C(=O)OC(C)C(=O)NC3=C(C=CC=C3F)F

InChI

InChI=1S/C22H20F2N2O3/c1-12(2)19-11-15(14-7-4-5-10-18(14)25-19)22(28)29-13(3)21(27)26-20-16(23)8-6-9-17(20)24/h4-13H,1-3H3,(H,26,27)