2,3,3-tris(chloranyl)prop-2-enyl 5-[[3,5-bis(trifluoromethyl)phenyl]amino]-5-oxidanylidene-pentanoate

Systemtic Name: 2,3,3-tris(chloranyl)prop-2-enyl 5-[[3,5-bis(trifluoromethyl)phenyl]amino]-5-oxidanylidene-pentanoate Openeye Name: 2,3,3-trichloroallyl 5-[3,5-bis(trifluoromethyl)anilino]-5-oxo-pentanoate CAS Name: 5-[3,5-bis(trifluoromethyl)anilino]-5-oxopentanoic acid 2,3,3-trichloroprop-2-enyl ester IUPAC Name: 2,3,3-trichloroprop-2-enyl 5-[3,5-bis(trifluoromethyl)anilino]-5-oxopentanoate Traditional Name: 5-[3,5-bis(trifluoromethyl)anilino]-5-keto-valeric acid 2,3,3-trichloroallyl ester Formula: C16H12Cl3F6NO3 MolecularWeight: 486.620799

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C=C1C(F)(F)F)NC(=O)CCCC(=O)OCC(=C(Cl)Cl)Cl)C(F)(F)F

Isomeric SMILES

C1=C(C=C(C=C1C(F)(F)F)NC(=O)CCCC(=O)OCC(=C(Cl)Cl)Cl)C(F)(F)F

InChI

InChI=1S/C16H12Cl3F6NO3/c17-11(14(18)19)7-29-13(28)3-1-2-12(27)26-10-5-8(15(20,21)22)4-9(6-10)16(23,24)25/h4-6H,1-3,7H2,(H,26,27)