tris[2,2,3,3,4,4,5,5,6,6,7,7-dodecakis(fluoranyl)heptoxy]methylbenzene

Systemtic Name: tris[2,2,3,3,4,4,5,5,6,6,7,7-dodecakis(fluoranyl)heptoxy]methylbenzene Openeye Name: tris(2,2,3,3,4,4,5,5,6,6,7,7-dodecafluoroheptoxy)methylbenzene CAS Name: tris(2,2,3,3,4,4,5,5,6,6,7,7-dodecafluoroheptoxy)methylbenzene IUPAC Name: tris(2,2,3,3,4,4,5,5,6,6,7,7-dodecafluoroheptoxy)methylbenzene Traditional Name: tris(2,2,3,3,4,4,5,5,6,6,7,7-dodecafluoroheptoxy)methylbenzene Formula: C28H14F36O3 MolecularWeight: 1082.351475

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(OCC(C(C(C(C(C(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(OCC(C(C(C(C(C(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)OCC(C(C(C(C(C(F)F)(F)F)(F)F)(F)F)(F)F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)C(OCC(C(C(C(C(C(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(OCC(C(C(C(C(C(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)OCC(C(C(C(C(C(F)F)(F)F)(F)F)(F)F)(F)F)(F)F

InChI

InChI=1S/C28H14F36O3/c29-10(30)16(41,42)23(53,54)26(59,60)20(47,48)13(35,36)6-65-19(9-4-2-1-3-5-9,66-7-14(37,38)21(49,50)27(61,62)24(55,56)17(43,44)11(31)32)67-8-15(39,40)22(51,52)28(63,64)25(57,58)18(45,46)12(33)34/h1-5,10-12H,6-8H2