ethyl 3-[methyl-[[4-(trifluoromethyloxy)phenyl]methyl]carbamoyl]-5-nitro-benzoate

Systemtic Name: ethyl 3-[methyl-[[4-(trifluoromethyloxy)phenyl]methyl]carbamoyl]-5-nitro-benzoate Openeye Name: ethyl 3-[methyl-[[4-(trifluoromethoxy)phenyl]methyl]carbamoyl]-5-nitro-benzoate CAS Name: 3-[[methyl-[[4-(trifluoromethoxy)phenyl]methyl]amino]-oxomethyl]-5-nitrobenzoic acid ethyl ester IUPAC Name: ethyl 3-[methyl-[[4-(trifluoromethoxy)phenyl]methyl]carbamoyl]-5-nitrobenzoate Traditional Name: 3-[methyl-[4-(trifluoromethoxy)benzyl]carbamoyl]-5-nitro-benzoic acid ethyl ester Formula: C19H17F3N2O6 MolecularWeight: 426.34329

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC(=C1)C(=O)N(C)CC2=CC=C(C=C2)OC(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=CC(=CC(=C1)C(=O)N(C)CC2=CC=C(C=C2)OC(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C19H17F3N2O6/c1-3-29-18(26)14-8-13(9-15(10-14)24(27)28)17(25)23(2)11-12-4-6-16(7-5-12)30-19(20,21)22/h4-10H,3,11H2,1-2H3