(2,6-ditert-butyl-4-octadecyl-phenyl) propanoate

Systemtic Name: (2,6-ditert-butyl-4-octadecyl-phenyl) propanoate Openeye Name: (2,6-ditert-butyl-4-octadecyl-phenyl) propanoate CAS Name: propanoic acid (2,6-ditert-butyl-4-octadecylphenyl) ester IUPAC Name: (2,6-ditert-butyl-4-octadecylphenyl) propanoate Traditional Name: propionic acid (2,6-ditert-butyl-4-stearyl-phenyl) ester Formula: C35H62O2 MolecularWeight: 514.86558

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCC1=CC(=C(C(=C1)C(C)(C)C)OC(=O)CC)C(C)(C)C

Isomeric SMILES

CCCCCCCCCCCCCCCCCCC1=CC(=C(C(=C1)C(C)(C)C)OC(=O)CC)C(C)(C)C

InChI

InChI=1S/C35H62O2/c1-9-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-29-27-30(34(3,4)5)33(37-32(36)10-2)31(28-29)35(6,7)8/h27-28H,9-26H2,1-8H3