1-[1,25-bis(phenylmethoxy)pentacosan-13-yloxy]-2,3-bis(fluoranyl)-4-phenyl-benzene

Systemtic Name: 1-[1,25-bis(phenylmethoxy)pentacosan-13-yloxy]-2,3-bis(fluoranyl)-4-phenyl-benzene Openeye Name: 1-[13-benzyloxy-1-(12-benzyloxydodecyl)tridecoxy]-2,3-difluoro-4-phenyl-benzene CAS Name: 1-[1,25-bis(phenylmethoxy)pentacosan-13-yloxy]-2,3-difluoro-4-phenylbenzene IUPAC Name: 1-[1,25-bis(phenylmethoxy)pentacosan-13-yloxy]-2,3-difluoro-4-phenylbenzene Traditional Name: 1-[13-benzoxy-1-(12-benzoxydodecyl)tridecoxy]-2,3-difluoro-4-phenyl-benzene Formula: C51H70F2O3 MolecularWeight: 769.096506

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COCCCCCCCCCCCCC(CCCCCCCCCCCCOCC2=CC=CC=C2)OC3=C(C(=C(C=C3)C4=CC=CC=C4)F)F

Isomeric SMILES

C1=CC=C(C=C1)COCCCCCCCCCCCCC(CCCCCCCCCCCCOCC2=CC=CC=C2)OC3=C(C(=C(C=C3)C4=CC=CC=C4)F)F

InChI

InChI=1S/C51H70F2O3/c52-50-48(46-34-24-19-25-35-46)38-39-49(51(50)53)56-47(36-26-13-9-5-1-3-7-11-15-28-40-54-42-44-30-20-17-21-31-44)37-27-14-10-6-2-4-8-12-16-29-41-55-43-45-32-22-18-23-33-45/h17-25,30-35,38-39,47H,1-16,26-29,36-37,40-43H2