ethyl 3-[[4-acetamido-2-(trifluoromethyl)phenyl]carbamoyl]-5-nitro-benzoate

Systemtic Name: ethyl 3-[[4-acetamido-2-(trifluoromethyl)phenyl]carbamoyl]-5-nitro-benzoate Openeye Name: ethyl 3-[[4-acetamido-2-(trifluoromethyl)phenyl]carbamoyl]-5-nitro-benzoate CAS Name: 3-[[4-acetamido-2-(trifluoromethyl)anilino]-oxomethyl]-5-nitrobenzoic acid ethyl ester IUPAC Name: ethyl 3-[[4-acetamido-2-(trifluoromethyl)phenyl]carbamoyl]-5-nitrobenzoate Traditional Name: 3-[[4-acetamido-2-(trifluoromethyl)phenyl]carbamoyl]-5-nitro-benzoic acid ethyl ester Formula: C19H16F3N3O6 MolecularWeight: 439.34205

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H16F3N3O6/c1-3-31-18(28)12-6-11(7-14(8-12)25(29)30)17(27)24-16-5-4-13(23-10(2)26)9-15(16)19(20,21)22/h4-9H,3H2,1-2H3,(H,23,26)(H,24,27)