[2-(butan-2-ylamino)-2-oxidanylidene-ethyl] 5-[3-(trifluoromethyl)phenyl]furan-2-carboxylate

Systemtic Name: [2-(butan-2-ylamino)-2-oxidanylidene-ethyl] 5-[3-(trifluoromethyl)phenyl]furan-2-carboxylate Openeye Name: [2-oxo-2-(sec-butylamino)ethyl] 5-[3-(trifluoromethyl)phenyl]furan-2-carboxylate CAS Name: 5-[3-(trifluoromethyl)phenyl]-2-furancarboxylic acid [2-(butan-2-ylamino)-2-oxoethyl] ester IUPAC Name: [2-(butan-2-ylamino)-2-oxoethyl] 5-[3-(trifluoromethyl)phenyl]furan-2-carboxylate Traditional Name: 5-[3-(trifluoromethyl)phenyl]furan-2-carboxylic acid [2-keto-2-(sec-butylamino)ethyl] ester Formula: C18H18F3NO4 MolecularWeight: 369.33503

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)COC(=O)C1=CC=C(O1)C2=CC(=CC=C2)C(F)(F)F

Isomeric SMILES

CCC(C)NC(=O)COC(=O)C1=CC=C(O1)C2=CC(=CC=C2)C(F)(F)F

InChI

InChI=1S/C18H18F3NO4/c1-3-11(2)22-16(23)10-25-17(24)15-8-7-14(26-15)12-5-4-6-13(9-12)18(19,20)21/h4-9,11H,3,10H2,1-2H3,(H,22,23)