methyl (2E)-2-[[3-chloranyl-4-(trifluoromethyl)phenyl]methylidene]-3-oxidanylidene-butanoate

Systemtic Name: methyl (2E)-2-[[3-chloranyl-4-(trifluoromethyl)phenyl]methylidene]-3-oxidanylidene-butanoate Openeye Name: methyl (2E)-2-[[3-chloro-4-(trifluoromethyl)phenyl]methylene]-3-oxo-butanoate CAS Name: (2E)-2-[[3-chloro-4-(trifluoromethyl)phenyl]methylidene]-3-oxobutanoic acid methyl ester IUPAC Name: methyl (2E)-2-[[3-chloro-4-(trifluoromethyl)phenyl]methylidene]-3-oxobutanoate Traditional Name: (E)-2-acetyl-3-[3-chloro-4-(trifluoromethyl)phenyl]acrylic acid methyl ester Formula: C13H10ClF3O3 MolecularWeight: 306.66491

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(=CC1=CC(=C(C=C1)C(F)(F)F)Cl)C(=O)OC

Isomeric SMILES

CC(=O)/C(=C\C1=CC(=C(C=C1)C(F)(F)F)Cl)/C(=O)OC

InChI

InChI=1S/C13H10ClF3O3/c1-7(18)9(12(19)20-2)5-8-3-4-10(11(14)6-8)13(15,16)17/h3-6H,1-2H3/b9-5+