N-(4-acetamido-3-methyl-phenyl)-3-[[2-nitro-4-(trifluoromethyl)phenyl]amino]propanamide

Systemtic Name: N-(4-acetamido-3-methyl-phenyl)-3-[[2-nitro-4-(trifluoromethyl)phenyl]amino]propanamide Openeye Name: N-(4-acetamido-3-methyl-phenyl)-3-[2-nitro-4-(trifluoromethyl)anilino]propanamide CAS Name: N-(4-acetamido-3-methylphenyl)-3-[2-nitro-4-(trifluoromethyl)anilino]propanamide IUPAC Name: N-(4-acetamido-3-methylphenyl)-3-[2-nitro-4-(trifluoromethyl)anilino]propanamide Traditional Name: N-(4-acetamido-3-methyl-phenyl)-3-[2-nitro-4-(trifluoromethyl)anilino]propionamide Formula: C19H19F3N4O4 MolecularWeight: 424.37377

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=O)CCNC2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-])NC(=O)C

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)CCNC2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-])NC(=O)C

InChI

InChI=1S/C19H19F3N4O4/c1-11-9-14(4-6-15(11)24-12(2)27)25-18(28)7-8-23-16-5-3-13(19(20,21)22)10-17(16)26(29)30/h3-6,9-10,23H,7-8H2,1-2H3,(H,24,27)(H,25,28)