1-[3-(3-fluoranyl-4-methyl-phenyl)-1,2,4-oxadiazol-5-yl]ethyl quinoline-2-carboxylate

Systemtic Name: 1-[3-(3-fluoranyl-4-methyl-phenyl)-1,2,4-oxadiazol-5-yl]ethyl quinoline-2-carboxylate Openeye Name: 1-[3-(3-fluoro-4-methyl-phenyl)-1,2,4-oxadiazol-5-yl]ethyl quinoline-2-carboxylate CAS Name: 2-quinolinecarboxylic acid 1-[3-(3-fluoro-4-methylphenyl)-1,2,4-oxadiazol-5-yl]ethyl ester IUPAC Name: 1-[3-(3-fluoro-4-methylphenyl)-1,2,4-oxadiazol-5-yl]ethyl quinoline-2-carboxylate Traditional Name: quinaldic acid 1-[3-(3-fluoro-4-methyl-phenyl)-1,2,4-oxadiazol-5-yl]ethyl ester Formula: C21H16FN3O3 MolecularWeight: 377.368443

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NOC(=N2)C(C)OC(=O)C3=NC4=CC=CC=C4C=C3)F

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NOC(=N2)C(C)OC(=O)C3=NC4=CC=CC=C4C=C3)F

InChI

InChI=1S/C21H16FN3O3/c1-12-7-8-15(11-16(12)22)19-24-20(28-25-19)13(2)27-21(26)18-10-9-14-5-3-4-6-17(14)23-18/h3-11,13H,1-2H3