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

Systemtic Name: [3-(3,5-dimethylphenoxy)-6-hexyl-4-oxidanylidene-2-(trifluoromethyl)chromen-7-yl] 4-methoxybenzoate Openeye Name: [3-(3,5-dimethylphenoxy)-6-hexyl-4-oxo-2-(trifluoromethyl)chromen-7-yl] 4-methoxybenzoate CAS Name: 4-methoxybenzoic acid [3-(3,5-dimethylphenoxy)-6-hexyl-4-oxo-2-(trifluoromethyl)-1-benzopyran-7-yl] ester IUPAC Name: [3-(3,5-dimethylphenoxy)-6-hexyl-4-oxo-2-(trifluoromethyl)chromen-7-yl] 4-methoxybenzoate Traditional Name: 4-methoxybenzoic acid [3-(3,5-dimethylphenoxy)-6-hexyl-4-keto-2-(trifluoromethyl)chromen-7-yl] ester Formula: C32H31F3O6 MolecularWeight: 568.58015

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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)OC(=O)C4=CC=C(C=C4)OC

Isomeric SMILES

CCCCCCC1=C(C=C2C(=C1)C(=O)C(=C(O2)C(F)(F)F)OC3=CC(=CC(=C3)C)C)OC(=O)C4=CC=C(C=C4)OC

InChI

InChI=1S/C32H31F3O6/c1-5-6-7-8-9-22-17-25-27(18-26(22)41-31(37)21-10-12-23(38-4)13-11-21)40-30(32(33,34)35)29(28(25)36)39-24-15-19(2)14-20(3)16-24/h10-18H,5-9H2,1-4H3