3-cyanopropyl 3-(2-chloranyl-6-fluoranyl-phenyl)-5-methyl-1,2-oxazole-4-carboxylate

Systemtic Name: 3-cyanopropyl 3-(2-chloranyl-6-fluoranyl-phenyl)-5-methyl-1,2-oxazole-4-carboxylate Openeye Name: 3-cyanopropyl 3-(2-chloro-6-fluoro-phenyl)-5-methyl-isoxazole-4-carboxylate CAS Name: 3-(2-chloro-6-fluorophenyl)-5-methyl-4-isoxazolecarboxylic acid 3-cyanopropyl ester IUPAC Name: 3-cyanopropyl 3-(2-chloro-6-fluorophenyl)-5-methyl-1,2-oxazole-4-carboxylate Traditional Name: 3-(2-chloro-6-fluoro-phenyl)-5-methyl-isoxazole-4-carboxylic acid 3-cyanopropyl ester Formula: C15H12ClFN2O3 MolecularWeight: 322.718783

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C2=C(C=CC=C2Cl)F)C(=O)OCCCC#N

Isomeric SMILES

CC1=C(C(=NO1)C2=C(C=CC=C2Cl)F)C(=O)OCCCC#N

InChI

InChI=1S/C15H12ClFN2O3/c1-9-12(15(20)21-8-3-2-7-18)14(19-22-9)13-10(16)5-4-6-11(13)17/h4-6H,2-3,8H2,1H3