(4-cyano-2-fluoranyl-phenyl)methyl 3-methyl-5-propan-2-yl-1,2-oxazole-4-carboxylate

Systemtic Name: (4-cyano-2-fluoranyl-phenyl)methyl 3-methyl-5-propan-2-yl-1,2-oxazole-4-carboxylate Openeye Name: (4-cyano-2-fluoro-phenyl)methyl 5-isopropyl-3-methyl-isoxazole-4-carboxylate CAS Name: 3-methyl-5-propan-2-yl-4-isoxazolecarboxylic acid (4-cyano-2-fluorophenyl)methyl ester IUPAC Name: (4-cyano-2-fluorophenyl)methyl 3-methyl-5-propan-2-yl-1,2-oxazole-4-carboxylate Traditional Name: 5-isopropyl-3-methyl-isoxazole-4-carboxylic acid (4-cyano-2-fluoro-benzyl) ester Formula: C16H15FN2O3 MolecularWeight: 302.300303

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=C1C(=O)OCC2=C(C=C(C=C2)C#N)F)C(C)C

Isomeric SMILES

CC1=NOC(=C1C(=O)OCC2=C(C=C(C=C2)C#N)F)C(C)C

InChI

InChI=1S/C16H15FN2O3/c1-9(2)15-14(10(3)19-22-15)16(20)21-8-12-5-4-11(7-18)6-13(12)17/h4-6,9H,8H2,1-3H3