[4-[1,1,1-tris(fluoranyl)-4-oxidanylidene-decan-2-yl]oxycarbonylphenyl] 4-octoxybenzoate

Systemtic Name: [4-[1,1,1-tris(fluoranyl)-4-oxidanylidene-decan-2-yl]oxycarbonylphenyl] 4-octoxybenzoate Openeye Name: [4-[3-oxo-1-(trifluoromethyl)nonoxy]carbonylphenyl] 4-octoxybenzoate CAS Name: 4-octoxybenzoic acid [4-[oxo-(1,1,1-trifluoro-4-oxodecan-2-yl)oxymethyl]phenyl] ester IUPAC Name: [4-(1,1,1-trifluoro-4-oxodecan-2-yl)oxycarbonylphenyl] 4-octoxybenzoate Traditional Name: 4-octoxybenzoic acid [4-[3-keto-1-(trifluoromethyl)nonoxy]carbonylphenyl] ester Formula: C32H41F3O6 MolecularWeight: 578.65955

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C(=O)OC(CC(=O)CCCCCC)C(F)(F)F

Isomeric SMILES

CCCCCCCCOC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C(=O)OC(CC(=O)CCCCCC)C(F)(F)F

InChI

InChI=1S/C32H41F3O6/c1-3-5-7-9-10-12-22-39-27-18-14-24(15-19-27)30(37)40-28-20-16-25(17-21-28)31(38)41-29(32(33,34)35)23-26(36)13-11-8-6-4-2/h14-21,29H,3-13,22-23H2,1-2H3