bis[4-[3,4,5-tri(nonoxy)phenoxy]phenyl]methanone

Systemtic Name: bis[4-[3,4,5-tri(nonoxy)phenoxy]phenyl]methanone Openeye Name: bis[4-[3,4,5-tri(nonoxy)phenoxy]phenyl]methanone CAS Name: bis[4-[3,4,5-tri(nonoxy)phenoxy]phenyl]methanone IUPAC Name: bis[4-[3,4,5-tri(nonoxy)phenoxy]phenyl]methanone Traditional Name: bis[4-[3,4,5-tri(nonoxy)phenoxy]phenyl]methanone Formula: C79H126O9 MolecularWeight: 1219.84034

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCOC1=CC(=CC(=C1OCCCCCCCCC)OCCCCCCCCC)OC2=CC=C(C=C2)C(=O)C3=CC=C(C=C3)OC4=CC(=C(C(=C4)OCCCCCCCCC)OCCCCCCCCC)OCCCCCCCCC

Isomeric SMILES

CCCCCCCCCOC1=CC(=CC(=C1OCCCCCCCCC)OCCCCCCCCC)OC2=CC=C(C=C2)C(=O)C3=CC=C(C=C3)OC4=CC(=C(C(=C4)OCCCCCCCCC)OCCCCCCCCC)OCCCCCCCCC

InChI

InChI=1S/C79H126O9/c1-7-13-19-25-31-37-43-57-81-73-63-71(64-74(82-58-44-38-32-26-20-14-8-2)78(73)85-61-47-41-35-29-23-17-11-5)87-69-53-49-67(50-54-69)77(80)68-51-55-70(56-52-68)88-72-65-75(83-59-45-39-33-27-21-15-9-3)79(86-62-48-42-36-30-24-18-12-6)76(66-72)84-60-46-40-34-28-22-16-10-4/h49-56,63-66H,7-48,57-62H2,1-6H3