1-[4-cyano-3-(trifluoromethyl)phenyl]-4-methyl-2-oxidanylidene-imidazolidine-4-carboxylic acid

Systemtic Name: 1-[4-cyano-3-(trifluoromethyl)phenyl]-4-methyl-2-oxidanylidene-imidazolidine-4-carboxylic acid Openeye Name: 1-[4-cyano-3-(trifluoromethyl)phenyl]-4-methyl-2-oxo-imidazolidine-4-carboxylic acid CAS Name: 1-[4-cyano-3-(trifluoromethyl)phenyl]-4-methyl-2-oxo-4-imidazolidinecarboxylic acid IUPAC Name: 1-[4-cyano-3-(trifluoromethyl)phenyl]-4-methyl-2-oxoimidazolidine-4-carboxylic acid Traditional Name: 1-[4-cyano-3-(trifluoromethyl)phenyl]-2-keto-4-methyl-imidazolidine-4-carboxylic acid Formula: C13H10F3N3O3 MolecularWeight: 313.23201

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(CN(C(=O)N1)C2=CC(=C(C=C2)C#N)C(F)(F)F)C(=O)O

Isomeric SMILES

CC1(CN(C(=O)N1)C2=CC(=C(C=C2)C#N)C(F)(F)F)C(=O)O

InChI

InChI=1S/C13H10F3N3O3/c1-12(10(20)21)6-19(11(22)18-12)8-3-2-7(5-17)9(4-8)13(14,15)16/h2-4H,6H2,1H3,(H,18,22)(H,20,21)