ethyl N-acetamido-N-[5-[2-chloranyl-4-(trifluoromethyl)phenoxy]-2-nitro-phenyl]carbamate

Systemtic Name: ethyl N-acetamido-N-[5-[2-chloranyl-4-(trifluoromethyl)phenoxy]-2-nitro-phenyl]carbamate Openeye Name: ethyl N-acetamido-N-[5-[2-chloro-4-(trifluoromethyl)phenoxy]-2-nitro-phenyl]carbamate CAS Name: N-acetamido-N-[5-[2-chloro-4-(trifluoromethyl)phenoxy]-2-nitrophenyl]carbamic acid ethyl ester IUPAC Name: ethyl N-acetamido-N-[5-[2-chloro-4-(trifluoromethyl)phenoxy]-2-nitrophenyl]carbamate Traditional Name: N-acetamido-N-[5-[2-chloro-4-(trifluoromethyl)phenoxy]-2-nitro-phenyl]carbamic acid ethyl ester Formula: C18H15ClF3N3O6 MolecularWeight: 461.77641

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N(C1=C(C=CC(=C1)OC2=C(C=C(C=C2)C(F)(F)F)Cl)[N+](=O)[O-])NC(=O)C

Isomeric SMILES

CCOC(=O)N(C1=C(C=CC(=C1)OC2=C(C=C(C=C2)C(F)(F)F)Cl)[N+](=O)[O-])NC(=O)C

InChI

InChI=1S/C18H15ClF3N3O6/c1-3-30-17(27)24(23-10(2)26)15-9-12(5-6-14(15)25(28)29)31-16-7-4-11(8-13(16)19)18(20,21)22/h4-9H,3H2,1-2H3,(H,23,26)