[1-[bis(fluoranyl)methyl]imidazol-2-yl]methyl 2-ethyl-3-methyl-quinoline-4-carboxylate

Systemtic Name: [1-[bis(fluoranyl)methyl]imidazol-2-yl]methyl 2-ethyl-3-methyl-quinoline-4-carboxylate Openeye Name: [1-(difluoromethyl)imidazol-2-yl]methyl 2-ethyl-3-methyl-quinoline-4-carboxylate CAS Name: 2-ethyl-3-methyl-4-quinolinecarboxylic acid [1-(difluoromethyl)-2-imidazolyl]methyl ester IUPAC Name: [1-(difluoromethyl)imidazol-2-yl]methyl 2-ethyl-3-methylquinoline-4-carboxylate Traditional Name: 2-ethyl-3-methyl-cinchoninic acid [1-(difluoromethyl)imidazol-2-yl]methyl ester Formula: C18H17F2N3O2 MolecularWeight: 345.343286

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=CC=CC=C2C(=C1C)C(=O)OCC3=NC=CN3C(F)F

Isomeric SMILES

CCC1=NC2=CC=CC=C2C(=C1C)C(=O)OCC3=NC=CN3C(F)F

InChI

InChI=1S/C18H17F2N3O2/c1-3-13-11(2)16(12-6-4-5-7-14(12)22-13)17(24)25-10-15-21-8-9-23(15)18(19)20/h4-9,18H,3,10H2,1-2H3