[4-[1,1,1-tris(fluoranyl)decan-2-yloxycarbonyl]phenyl] 4-undecanoyloxybenzoate

Systemtic Name: [4-[1,1,1-tris(fluoranyl)decan-2-yloxycarbonyl]phenyl] 4-undecanoyloxybenzoate Openeye Name: [4-[1-(trifluoromethyl)nonoxycarbonyl]phenyl] 4-undecanoyloxybenzoate CAS Name: 4-(1-oxoundecoxy)benzoic acid [4-[oxo(1,1,1-trifluorodecan-2-yloxy)methyl]phenyl] ester IUPAC Name: [4-(1,1,1-trifluorodecan-2-yloxycarbonyl)phenyl] 4-undecanoyloxybenzoate Traditional Name: 4-undecanoyloxybenzoic acid [4-[1-(trifluoromethyl)nonoxycarbonyl]phenyl] ester Formula: C35H47F3O6 MolecularWeight: 620.73929

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC(=O)OC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C(=O)OC(CCCCCCCC)C(F)(F)F

Isomeric SMILES

CCCCCCCCCCC(=O)OC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C(=O)OC(CCCCCCCC)C(F)(F)F

InChI

InChI=1S/C35H47F3O6/c1-3-5-7-9-11-12-14-16-18-32(39)42-29-23-19-27(20-24-29)33(40)43-30-25-21-28(22-26-30)34(41)44-31(35(36,37)38)17-15-13-10-8-6-4-2/h19-26,31H,3-18H2,1-2H3