[3-(2-chlorophenyl)-4-oxidanylidene-2-(trifluoromethyl)chromen-7-yl] 3,5-dinitrobenzoate

Systemtic Name: [3-(2-chlorophenyl)-4-oxidanylidene-2-(trifluoromethyl)chromen-7-yl] 3,5-dinitrobenzoate Openeye Name: [3-(2-chlorophenyl)-4-oxo-2-(trifluoromethyl)chromen-7-yl] 3,5-dinitrobenzoate CAS Name: 3,5-dinitrobenzoic acid [3-(2-chlorophenyl)-4-oxo-2-(trifluoromethyl)-1-benzopyran-7-yl] ester IUPAC Name: [3-(2-chlorophenyl)-4-oxo-2-(trifluoromethyl)chromen-7-yl] 3,5-dinitrobenzoate Traditional Name: 3,5-dinitrobenzoic acid [3-(2-chlorophenyl)-4-keto-2-(trifluoromethyl)chromen-7-yl] ester Formula: C23H10ClF3N2O8 MolecularWeight: 534.78231

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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-])[N+](=O)[O-])C(F)(F)F)Cl

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-])[N+](=O)[O-])C(F)(F)F)Cl

InChI

InChI=1S/C23H10ClF3N2O8/c24-17-4-2-1-3-15(17)19-20(30)16-6-5-14(10-18(16)37-21(19)23(25,26)27)36-22(31)11-7-12(28(32)33)9-13(8-11)29(34)35/h1-10H