[4-oxidanylidene-3-phenyl-2-(trifluoromethyl)chromen-7-yl] 3-nitrobenzoate

Systemtic Name: [4-oxidanylidene-3-phenyl-2-(trifluoromethyl)chromen-7-yl] 3-nitrobenzoate Openeye Name: [4-oxo-3-phenyl-2-(trifluoromethyl)chromen-7-yl] 3-nitrobenzoate CAS Name: 3-nitrobenzoic acid [4-oxo-3-phenyl-2-(trifluoromethyl)-1-benzopyran-7-yl] ester IUPAC Name: [4-oxo-3-phenyl-2-(trifluoromethyl)chromen-7-yl] 3-nitrobenzoate Traditional Name: 3-nitrobenzoic acid [4-keto-3-phenyl-2-(trifluoromethyl)chromen-7-yl] ester Formula: C23H12F3NO6 MolecularWeight: 455.33969

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(OC3=C(C2=O)C=CC(=C3)OC(=O)C4=CC(=CC=C4)[N+](=O)[O-])C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)C2=C(OC3=C(C2=O)C=CC(=C3)OC(=O)C4=CC(=CC=C4)[N+](=O)[O-])C(F)(F)F

InChI

InChI=1S/C23H12F3NO6/c24-23(25,26)21-19(13-5-2-1-3-6-13)20(28)17-10-9-16(12-18(17)33-21)32-22(29)14-7-4-8-15(11-14)27(30)31/h1-12H