ethyl 3-[[2-(dimethylamino)-5-(trifluoromethyl)phenyl]carbamoyl]-5-nitro-benzoate

Systemtic Name: ethyl 3-[[2-(dimethylamino)-5-(trifluoromethyl)phenyl]carbamoyl]-5-nitro-benzoate Openeye Name: ethyl 3-[[2-(dimethylamino)-5-(trifluoromethyl)phenyl]carbamoyl]-5-nitro-benzoate CAS Name: 3-[[2-(dimethylamino)-5-(trifluoromethyl)anilino]-oxomethyl]-5-nitrobenzoic acid ethyl ester IUPAC Name: ethyl 3-[[2-(dimethylamino)-5-(trifluoromethyl)phenyl]carbamoyl]-5-nitrobenzoate Traditional Name: 3-[[2-(dimethylamino)-5-(trifluoromethyl)phenyl]carbamoyl]-5-nitro-benzoic acid ethyl ester Formula: C19H18F3N3O5 MolecularWeight: 425.35853

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC(=C1)C(=O)NC2=C(C=CC(=C2)C(F)(F)F)N(C)C)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=CC(=CC(=C1)C(=O)NC2=C(C=CC(=C2)C(F)(F)F)N(C)C)[N+](=O)[O-]

InChI

InChI=1S/C19H18F3N3O5/c1-4-30-18(27)12-7-11(8-14(9-12)25(28)29)17(26)23-15-10-13(19(20,21)22)5-6-16(15)24(2)3/h5-10H,4H2,1-3H3,(H,23,26)