methyl 2-[3,5-bis(trifluoromethyl)phenyl]carbonyl-3-(methylamino)but-2-enoate

Systemtic Name: methyl 2-[3,5-bis(trifluoromethyl)phenyl]carbonyl-3-(methylamino)but-2-enoate Openeye Name: methyl 2-[3,5-bis(trifluoromethyl)benzoyl]-3-(methylamino)but-2-enoate CAS Name: 2-[[3,5-bis(trifluoromethyl)phenyl]-oxomethyl]-3-(methylamino)-2-butenoic acid methyl ester IUPAC Name: methyl 2-[3,5-bis(trifluoromethyl)benzoyl]-3-(methylamino)but-2-enoate Traditional Name: 2-[3,5-bis(trifluoromethyl)benzoyl]-3-(methylamino)but-2-enoic acid methyl ester Formula: C15H13F6NO3 MolecularWeight: 369.259039

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C(C(=O)C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)C(=O)OC)NC

Isomeric SMILES

CC(=C(C(=O)C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)C(=O)OC)NC

InChI

InChI=1S/C15H13F6NO3/c1-7(22-2)11(13(24)25-3)12(23)8-4-9(14(16,17)18)6-10(5-8)15(19,20)21/h4-6,22H,1-3H3