[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]methyl 6-chloranyl-2-methyl-quinoline-3-carboxylate

Systemtic Name: [3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]methyl 6-chloranyl-2-methyl-quinoline-3-carboxylate Openeye Name: [3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]methyl 6-chloro-2-methyl-quinoline-3-carboxylate CAS Name: 6-chloro-2-methyl-3-quinolinecarboxylic acid [3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]methyl ester IUPAC Name: [3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]methyl 6-chloro-2-methylquinoline-3-carboxylate Traditional Name: 6-chloro-2-methyl-quinoline-3-carboxylic acid [3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]methyl ester Formula: C20H13ClFN3O3 MolecularWeight: 397.786923

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C=C(C=CC2=N1)Cl)C(=O)OCC3=NC(=NO3)C4=CC=C(C=C4)F

Isomeric SMILES

CC1=C(C=C2C=C(C=CC2=N1)Cl)C(=O)OCC3=NC(=NO3)C4=CC=C(C=C4)F

InChI

InChI=1S/C20H13ClFN3O3/c1-11-16(9-13-8-14(21)4-7-17(13)23-11)20(26)27-10-18-24-19(25-28-18)12-2-5-15(22)6-3-12/h2-9H,10H2,1H3