2-methylpropyl 2-[3-(3,5-dimethylphenoxy)-6-hexyl-4-oxidanylidene-2-(trifluoromethyl)chromen-7-yl]oxyethanoate

Systemtic Name: 2-methylpropyl 2-[3-(3,5-dimethylphenoxy)-6-hexyl-4-oxidanylidene-2-(trifluoromethyl)chromen-7-yl]oxyethanoate Openeye Name: isobutyl 2-[3-(3,5-dimethylphenoxy)-6-hexyl-4-oxo-2-(trifluoromethyl)chromen-7-yl]oxyacetate CAS Name: 2-[[3-(3,5-dimethylphenoxy)-6-hexyl-4-oxo-2-(trifluoromethyl)-1-benzopyran-7-yl]oxy]acetic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 2-[3-(3,5-dimethylphenoxy)-6-hexyl-4-oxo-2-(trifluoromethyl)chromen-7-yl]oxyacetate Traditional Name: 2-[3-(3,5-dimethylphenoxy)-6-hexyl-4-keto-2-(trifluoromethyl)chromen-7-yl]oxyacetic acid isobutyl ester Formula: C30H35F3O6 MolecularWeight: 548.59051

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=C(C=C2C(=C1)C(=O)C(=C(O2)C(F)(F)F)OC3=CC(=CC(=C3)C)C)OCC(=O)OCC(C)C

Isomeric SMILES

CCCCCCC1=C(C=C2C(=C1)C(=O)C(=C(O2)C(F)(F)F)OC3=CC(=CC(=C3)C)C)OCC(=O)OCC(C)C

InChI

InChI=1S/C30H35F3O6/c1-6-7-8-9-10-21-14-23-25(15-24(21)36-17-26(34)37-16-18(2)3)39-29(30(31,32)33)28(27(23)35)38-22-12-19(4)11-20(5)13-22/h11-15,18H,6-10,16-17H2,1-5H3