diethyl decanedioate; 5-methyl-N-[4-(trifluoromethyl)phenyl]-1,2-oxazole-4-carboxamide

Systemtic Name: diethyl decanedioate; 5-methyl-N-[4-(trifluoromethyl)phenyl]-1,2-oxazole-4-carboxamide Openeye Name: diethyl decanedioate; 5-methyl-N-[4-(trifluoromethyl)phenyl]isoxazole-4-carboxamide CAS Name: decanedioic acid diethyl ester; 5-methyl-N-[4-(trifluoromethyl)phenyl]-4-isoxazolecarboxamide IUPAC Name: diethyl decanedioate; 5-methyl-N-[4-(trifluoromethyl)phenyl]-1,2-oxazole-4-carboxamide Traditional Name: 5-methyl-N-[4-(trifluoromethyl)phenyl]isoxazole-4-carboxamide; sebacic acid diethyl ester Formula: C26H35F3N2O6 MolecularWeight: 528.56111

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCCCCCCC(=O)OCC.CC1=C(C=NO1)C(=O)NC2=CC=C(C=C2)C(F)(F)F

Isomeric SMILES

CCOC(=O)CCCCCCCCC(=O)OCC.CC1=C(C=NO1)C(=O)NC2=CC=C(C=C2)C(F)(F)F

InChI

InChI=1S/C14H26O4.C12H9F3N2O2/c1-3-17-13(15)11-9-7-5-6-8-10-12-14(16)18-4-2;1-7-10(6-16-19-7)11(18)17-9-4-2-8(3-5-9)12(13,14)15/h3-12H2,1-2H3;2-6H,1H3,(H,17,18)