[4-oxidanylidene-3-(2,3,5-trimethylphenoxy)chromen-7-yl] 4-fluoranylbenzoate

Systemtic Name: [4-oxidanylidene-3-(2,3,5-trimethylphenoxy)chromen-7-yl] 4-fluoranylbenzoate Openeye Name: [4-oxo-3-(2,3,5-trimethylphenoxy)chromen-7-yl] 4-fluorobenzoate CAS Name: 4-fluorobenzoic acid [4-oxo-3-(2,3,5-trimethylphenoxy)-1-benzopyran-7-yl] ester IUPAC Name: [4-oxo-3-(2,3,5-trimethylphenoxy)chromen-7-yl] 4-fluorobenzoate Traditional Name: 4-fluorobenzoic acid [4-keto-3-(2,3,5-trimethylphenoxy)chromen-7-yl] ester Formula: C25H19FO5 MolecularWeight: 418.413763

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)OC2=COC3=C(C2=O)C=CC(=C3)OC(=O)C4=CC=C(C=C4)F)C)C

Isomeric SMILES

CC1=CC(=C(C(=C1)OC2=COC3=C(C2=O)C=CC(=C3)OC(=O)C4=CC=C(C=C4)F)C)C

InChI

InChI=1S/C25H19FO5/c1-14-10-15(2)16(3)21(11-14)31-23-13-29-22-12-19(8-9-20(22)24(23)27)30-25(28)17-4-6-18(26)7-5-17/h4-13H,1-3H3