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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OC2=C(OC3=C(C2=O)C=CC(=C3)OC(=O)C4CCCCC4)C(F)(F)F

Isomeric SMILES

CC1=CC(=CC=C1)OC2=C(OC3=C(C2=O)C=CC(=C3)OC(=O)C4CCCCC4)C(F)(F)F

InChI

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