bis[11-[4-(4-cyanophenyl)phenoxy]undecyl] propanedioate

Systemtic Name: bis[11-[4-(4-cyanophenyl)phenoxy]undecyl] propanedioate Openeye Name: bis[11-[4-(4-cyanophenyl)phenoxy]undecyl] propanedioate CAS Name: propanedioic acid bis[11-[4-(4-cyanophenyl)phenoxy]undecyl] ester IUPAC Name: bis[11-[4-(4-cyanophenyl)phenoxy]undecyl] propanedioate Traditional Name: malonic acid bis[11-[4-(4-cyanophenyl)phenoxy]undecyl] ester Formula: C51H62N2O6 MolecularWeight: 799.04778

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C#N)C2=CC=C(C=C2)OCCCCCCCCCCCOC(=O)CC(=O)OCCCCCCCCCCCOC3=CC=C(C=C3)C4=CC=C(C=C4)C#N

Isomeric SMILES

C1=CC(=CC=C1C#N)C2=CC=C(C=C2)OCCCCCCCCCCCOC(=O)CC(=O)OCCCCCCCCCCCOC3=CC=C(C=C3)C4=CC=C(C=C4)C#N

InChI

InChI=1S/C51H62N2O6/c52-40-42-19-23-44(24-20-42)46-27-31-48(32-28-46)56-35-15-11-7-3-1-5-9-13-17-37-58-50(54)39-51(55)59-38-18-14-10-6-2-4-8-12-16-36-57-49-33-29-47(30-34-49)45-25-21-43(41-53)22-26-45/h19-34H,1-18,35-39H2