4-[4-[[(3R,3aS,6S,7aS)-3-[2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,9-heptadecakis(fluoranyl)nonyl]-3,3a,4,5,6,7a-hexahydro-2H-furo[2,3-b]pyran-6-yl]methoxy]phenyl]benzenecarbonitrile

Systemtic Name: 4-[4-[[(3R,3aS,6S,7aS)-3-[2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,9-heptadecakis(fluoranyl)nonyl]-3,3a,4,5,6,7a-hexahydro-2H-furo[2,3-b]pyran-6-yl]methoxy]phenyl]benzenecarbonitrile Openeye Name: 4-[4-[[(3R,3aS,6S,7aS)-3-(2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,9-heptadecafluorononyl)-3,3a,4,5,6,7a-hexahydro-2H-furo[2,3-b]pyran-6-yl]methoxy]phenyl]benzonitrile CAS Name: 4-[4-[[(3R,3aS,6S,7aS)-3-(2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,9-heptadecafluorononyl)-3,3a,4,5,6,7a-hexahydro-2H-furo[2,3-b]pyran-6-yl]methoxy]phenyl]benzonitrile IUPAC Name: 4-[4-[[(3R,3aS,6S,7aS)-3-(2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,9-heptadecafluorononyl)-3,3a,4,5,6,7a-hexahydro-2H-furo[2,3-b]pyran-6-yl]methoxy]phenyl]benzonitrile Traditional Name: 4-[4-[[(3R,3aS,6S,7aS)-3-(2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,9-heptadecafluorononyl)-3,3a,4,5,6,7a-hexahydro-2H-furo[2,3-b]pyran-6-yl]methoxy]phenyl]benzonitrile Formula: C30H22F17NO3 MolecularWeight: 767.473434

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2C(COC2OC1COC3=CC=C(C=C3)C4=CC=C(C=C4)C#N)CC(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F

Isomeric SMILES

C1C[C@H]2[C@H](CO[C@H]2O[C@@H]1COC3=CC=C(C=C3)C4=CC=C(C=C4)C#N)CC(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F

InChI

InChI=1S/C30H22F17NO3/c31-23(32,24(33,34)25(35,36)26(37,38)27(39,40)28(41,42)29(43,44)30(45,46)47)11-18-13-50-22-21(18)10-9-20(51-22)14-49-19-7-5-17(6-8-19)16-3-1-15(12-48)2-4-16/h1-8,18,20-22H,9-11,13-14H2/t18-,20-,21-,22-/m0/s1