[3-(2-chlorophenyl)-4-oxidanylidene-2-(trifluoromethyl)chromen-7-yl] 3-methyl-4-nitro-benzoate

Systemtic Name: [3-(2-chlorophenyl)-4-oxidanylidene-2-(trifluoromethyl)chromen-7-yl] 3-methyl-4-nitro-benzoate Openeye Name: [3-(2-chlorophenyl)-4-oxo-2-(trifluoromethyl)chromen-7-yl] 3-methyl-4-nitro-benzoate CAS Name: 3-methyl-4-nitrobenzoic 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-methyl-4-nitrobenzoate Traditional Name: 3-methyl-4-nitro-benzoic acid [3-(2-chlorophenyl)-4-keto-2-(trifluoromethyl)chromen-7-yl] ester Formula: C24H13ClF3NO6 MolecularWeight: 503.81133

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)OC2=CC3=C(C=C2)C(=O)C(=C(O3)C(F)(F)F)C4=CC=CC=C4Cl)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)OC2=CC3=C(C=C2)C(=O)C(=C(O3)C(F)(F)F)C4=CC=CC=C4Cl)[N+](=O)[O-]

InChI

InChI=1S/C24H13ClF3NO6/c1-12-10-13(6-9-18(12)29(32)33)23(31)34-14-7-8-16-19(11-14)35-22(24(26,27)28)20(21(16)30)15-4-2-3-5-17(15)25/h2-11H,1H3