[4-[5-(4-decoxyphenyl)pyridin-2-yl]phenyl] 2,6-dimethylheptanoate

Systemtic Name: [4-[5-(4-decoxyphenyl)pyridin-2-yl]phenyl] 2,6-dimethylheptanoate Openeye Name: [4-[5-(4-decoxyphenyl)-2-pyridyl]phenyl] 2,6-dimethylheptanoate CAS Name: 2,6-dimethylheptanoic acid [4-[5-(4-decoxyphenyl)-2-pyridinyl]phenyl] ester IUPAC Name: [4-[5-(4-decoxyphenyl)pyridin-2-yl]phenyl] 2,6-dimethylheptanoate Traditional Name: 2,6-dimethylenanthic acid [4-[5-(4-decoxyphenyl)-2-pyridyl]phenyl] ester Formula: C36H49NO3 MolecularWeight: 543.77916

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC1=CC=C(C=C1)C2=CN=C(C=C2)C3=CC=C(C=C3)OC(=O)C(C)CCCC(C)C

Isomeric SMILES

CCCCCCCCCCOC1=CC=C(C=C1)C2=CN=C(C=C2)C3=CC=C(C=C3)OC(=O)C(C)CCCC(C)C

InChI

InChI=1S/C36H49NO3/c1-5-6-7-8-9-10-11-12-26-39-33-21-16-30(17-22-33)32-20-25-35(37-27-32)31-18-23-34(24-19-31)40-36(38)29(4)15-13-14-28(2)3/h16-25,27-29H,5-15,26H2,1-4H3