N-[4-[2-(3-methyl-4-nitro-phenoxy)ethanoylamino]-3-(trifluoromethyl)phenyl]furan-2-carboxamide

Systemtic Name: N-[4-[2-(3-methyl-4-nitro-phenoxy)ethanoylamino]-3-(trifluoromethyl)phenyl]furan-2-carboxamide Openeye Name: N-[4-[[2-(3-methyl-4-nitro-phenoxy)acetyl]amino]-3-(trifluoromethyl)phenyl]furan-2-carboxamide CAS Name: N-[4-[[2-(3-methyl-4-nitrophenoxy)-1-oxoethyl]amino]-3-(trifluoromethyl)phenyl]-2-furancarboxamide IUPAC Name: N-[4-[[2-(3-methyl-4-nitrophenoxy)acetyl]amino]-3-(trifluoromethyl)phenyl]furan-2-carboxamide Traditional Name: N-[4-[[2-(3-methyl-4-nitro-phenoxy)acetyl]amino]-3-(trifluoromethyl)phenyl]-2-furamide Formula: C21H16F3N3O6 MolecularWeight: 463.36345

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCC(=O)NC2=C(C=C(C=C2)NC(=O)C3=CC=CO3)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)OCC(=O)NC2=C(C=C(C=C2)NC(=O)C3=CC=CO3)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C21H16F3N3O6/c1-12-9-14(5-7-17(12)27(30)31)33-11-19(28)26-16-6-4-13(10-15(16)21(22,23)24)25-20(29)18-3-2-8-32-18/h2-10H,11H2,1H3,(H,25,29)(H,26,28)