[3-[2-methyl-5-[4-(trifluoromethyl)phenyl]furan-3-yl]propanoylamino] 3-oxidanylidenepentanoate

Systemtic Name: [3-[2-methyl-5-[4-(trifluoromethyl)phenyl]furan-3-yl]propanoylamino] 3-oxidanylidenepentanoate Openeye Name: [3-[2-methyl-5-[4-(trifluoromethyl)phenyl]-3-furyl]propanoylamino] 3-oxopentanoate CAS Name: 3-oxopentanoic acid [[3-[2-methyl-5-[4-(trifluoromethyl)phenyl]-3-furanyl]-1-oxopropyl]amino] ester IUPAC Name: [3-[2-methyl-5-[4-(trifluoromethyl)phenyl]furan-3-yl]propanoylamino] 3-oxopentanoate Traditional Name: 3-ketovaleric acid [3-[2-methyl-5-[4-(trifluoromethyl)phenyl]-3-furyl]propanoylamino] ester Formula: C20H20F3NO5 MolecularWeight: 411.37171

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)CC(=O)ONC(=O)CCC1=C(OC(=C1)C2=CC=C(C=C2)C(F)(F)F)C

Isomeric SMILES

CCC(=O)CC(=O)ONC(=O)CCC1=C(OC(=C1)C2=CC=C(C=C2)C(F)(F)F)C

InChI

InChI=1S/C20H20F3NO5/c1-3-16(25)11-19(27)29-24-18(26)9-6-14-10-17(28-12(14)2)13-4-7-15(8-5-13)20(21,22)23/h4-5,7-8,10H,3,6,9,11H2,1-2H3,(H,24,26)