diethyl 2-[2-(4-octylphenyl)ethyl]-2-[3-(oxan-2-yloxy)propyl]propanedioate

Systemtic Name: diethyl 2-[2-(4-octylphenyl)ethyl]-2-[3-(oxan-2-yloxy)propyl]propanedioate Openeye Name: diethyl 2-[2-(4-octylphenyl)ethyl]-2-(3-tetrahydropyran-2-yloxypropyl)propanedioate CAS Name: 2-[2-(4-octylphenyl)ethyl]-2-[3-(2-oxanyloxy)propyl]propanedioic acid diethyl ester IUPAC Name: diethyl 2-[2-(4-octylphenyl)ethyl]-2-[3-(oxan-2-yloxy)propyl]propanedioate Traditional Name: 2-[2-(4-octylphenyl)ethyl]-2-(3-tetrahydropyran-2-yloxypropyl)malonic acid diethyl ester Formula: C31H50O6 MolecularWeight: 518.7251

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC=C(C=C1)CCC(CCCOC2CCCCO2)(C(=O)OCC)C(=O)OCC

Isomeric SMILES

CCCCCCCCC1=CC=C(C=C1)CCC(CCCOC2CCCCO2)(C(=O)OCC)C(=O)OCC

InChI

InChI=1S/C31H50O6/c1-4-7-8-9-10-11-15-26-17-19-27(20-18-26)21-23-31(29(32)34-5-2,30(33)35-6-3)22-14-25-37-28-16-12-13-24-36-28/h17-20,28H,4-16,21-25H2,1-3H3