[3-(2-methoxyphenyl)-4-oxidanylidene-2-(trifluoromethyl)chromen-7-yl] cyclohexanecarboxylate

Systemtic Name: [3-(2-methoxyphenyl)-4-oxidanylidene-2-(trifluoromethyl)chromen-7-yl] cyclohexanecarboxylate Openeye Name: [3-(2-methoxyphenyl)-4-oxo-2-(trifluoromethyl)chromen-7-yl] cyclohexanecarboxylate CAS Name: cyclohexanecarboxylic acid [3-(2-methoxyphenyl)-4-oxo-2-(trifluoromethyl)-1-benzopyran-7-yl] ester IUPAC Name: [3-(2-methoxyphenyl)-4-oxo-2-(trifluoromethyl)chromen-7-yl] cyclohexanecarboxylate Traditional Name: cyclohexanecarboxylic acid [4-keto-3-(2-methoxyphenyl)-2-(trifluoromethyl)chromen-7-yl] ester Formula: C24H21F3O5 MolecularWeight: 446.41575

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C2=C(OC3=C(C2=O)C=CC(=C3)OC(=O)C4CCCCC4)C(F)(F)F

Isomeric SMILES

COC1=CC=CC=C1C2=C(OC3=C(C2=O)C=CC(=C3)OC(=O)C4CCCCC4)C(F)(F)F

InChI

InChI=1S/C24H21F3O5/c1-30-18-10-6-5-9-16(18)20-21(28)17-12-11-15(13-19(17)32-22(20)24(25,26)27)31-23(29)14-7-3-2-4-8-14/h5-6,9-14H,2-4,7-8H2,1H3