[2-nitro-4-(trifluoromethyl)phenyl] 3-[2-(methylamino)-4-oxidanylidene-5-phenyl-furan-3-yl]benzoate

Systemtic Name: [2-nitro-4-(trifluoromethyl)phenyl] 3-[2-(methylamino)-4-oxidanylidene-5-phenyl-furan-3-yl]benzoate Openeye Name: [2-nitro-4-(trifluoromethyl)phenyl] 3-[2-(methylamino)-4-oxo-5-phenyl-3-furyl]benzoate CAS Name: 3-[2-(methylamino)-4-oxo-5-phenyl-3-furanyl]benzoic acid [2-nitro-4-(trifluoromethyl)phenyl] ester IUPAC Name: [2-nitro-4-(trifluoromethyl)phenyl] 3-[2-(methylamino)-4-oxo-5-phenylfuran-3-yl]benzoate Traditional Name: 3-[4-keto-2-(methylamino)-5-phenyl-3-furyl]benzoic acid [2-nitro-4-(trifluoromethyl)phenyl] ester Formula: C25H17F3N2O6 MolecularWeight: 498.40749

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=C(C(=O)C(O1)C2=CC=CC=C2)C3=CC(=CC=C3)C(=O)OC4=C(C=C(C=C4)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

CNC1=C(C(=O)C(O1)C2=CC=CC=C2)C3=CC(=CC=C3)C(=O)OC4=C(C=C(C=C4)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C25H17F3N2O6/c1-29-23-20(21(31)22(36-23)14-6-3-2-4-7-14)15-8-5-9-16(12-15)24(32)35-19-11-10-17(25(26,27)28)13-18(19)30(33)34/h2-13,22,29H,1H3