[2-[(4-butylphenyl)amino]-2-oxidanylidene-ethyl] 3-(trifluoromethyl)benzoate

Systemtic Name: [2-[(4-butylphenyl)amino]-2-oxidanylidene-ethyl] 3-(trifluoromethyl)benzoate Openeye Name: [2-(4-butylanilino)-2-oxo-ethyl] 3-(trifluoromethyl)benzoate CAS Name: 3-(trifluoromethyl)benzoic acid [2-(4-butylanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-butylanilino)-2-oxoethyl] 3-(trifluoromethyl)benzoate Traditional Name: 3-(trifluoromethyl)benzoic acid [2-(4-butylanilino)-2-keto-ethyl] ester Formula: C20H20F3NO3 MolecularWeight: 379.37291

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=O)COC(=O)C2=CC(=CC=C2)C(F)(F)F

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=O)COC(=O)C2=CC(=CC=C2)C(F)(F)F

InChI

InChI=1S/C20H20F3NO3/c1-2-3-5-14-8-10-17(11-9-14)24-18(25)13-27-19(26)15-6-4-7-16(12-15)20(21,22)23/h4,6-12H,2-3,5,13H2,1H3,(H,24,25)