[2-cyano-5-(trifluoromethyl)phenyl] 4-(2-methylpropanoylamino)benzoate

Systemtic Name: [2-cyano-5-(trifluoromethyl)phenyl] 4-(2-methylpropanoylamino)benzoate Openeye Name: [2-cyano-5-(trifluoromethyl)phenyl] 4-(2-methylpropanoylamino)benzoate CAS Name: 4-[(2-methyl-1-oxopropyl)amino]benzoic acid [2-cyano-5-(trifluoromethyl)phenyl] ester IUPAC Name: [2-cyano-5-(trifluoromethyl)phenyl] 4-(2-methylpropanoylamino)benzoate Traditional Name: 4-(isobutyrylamino)benzoic acid [2-cyano-5-(trifluoromethyl)phenyl] ester Formula: C19H15F3N2O3 MolecularWeight: 376.32921

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NC1=CC=C(C=C1)C(=O)OC2=C(C=CC(=C2)C(F)(F)F)C#N

Isomeric SMILES

CC(C)C(=O)NC1=CC=C(C=C1)C(=O)OC2=C(C=CC(=C2)C(F)(F)F)C#N

InChI

InChI=1S/C19H15F3N2O3/c1-11(2)17(25)24-15-7-4-12(5-8-15)18(26)27-16-9-14(19(20,21)22)6-3-13(16)10-23/h3-9,11H,1-2H3,(H,24,25)