[3-(2-chloranylphenoxy)-4-oxidanylidene-2-(trifluoromethyl)chromen-7-yl] 4-methyl-3,5-dinitro-benzoate

Systemtic Name: [3-(2-chloranylphenoxy)-4-oxidanylidene-2-(trifluoromethyl)chromen-7-yl] 4-methyl-3,5-dinitro-benzoate Openeye Name: [3-(2-chlorophenoxy)-4-oxo-2-(trifluoromethyl)chromen-7-yl] 4-methyl-3,5-dinitro-benzoate CAS Name: 4-methyl-3,5-dinitrobenzoic acid [3-(2-chlorophenoxy)-4-oxo-2-(trifluoromethyl)-1-benzopyran-7-yl] ester IUPAC Name: [3-(2-chlorophenoxy)-4-oxo-2-(trifluoromethyl)chromen-7-yl] 4-methyl-3,5-dinitrobenzoate Traditional Name: 4-methyl-3,5-dinitro-benzoic acid [3-(2-chlorophenoxy)-4-keto-2-(trifluoromethyl)chromen-7-yl] ester Formula: C24H12ClF3N2O9 MolecularWeight: 564.80829

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1[N+](=O)[O-])C(=O)OC2=CC3=C(C=C2)C(=O)C(=C(O3)C(F)(F)F)OC4=CC=CC=C4Cl)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1[N+](=O)[O-])C(=O)OC2=CC3=C(C=C2)C(=O)C(=C(O3)C(F)(F)F)OC4=CC=CC=C4Cl)[N+](=O)[O-]

InChI

InChI=1S/C24H12ClF3N2O9/c1-11-16(29(33)34)8-12(9-17(11)30(35)36)23(32)37-13-6-7-14-19(10-13)39-22(24(26,27)28)21(20(14)31)38-18-5-3-2-4-15(18)25/h2-10H,1H3