(2-octadecylphenyl) 5-tert-butyl-2-oxidanyl-benzoate

Systemtic Name: (2-octadecylphenyl) 5-tert-butyl-2-oxidanyl-benzoate Openeye Name: (2-octadecylphenyl) 5-tert-butyl-2-hydroxy-benzoate CAS Name: 5-tert-butyl-2-hydroxybenzoic acid (2-octadecylphenyl) ester IUPAC Name: (2-octadecylphenyl) 5-tert-butyl-2-hydroxybenzoate Traditional Name: 5-tert-butyl-2-hydroxy-benzoic acid (2-stearylphenyl) ester Formula: C35H54O3 MolecularWeight: 522.80146

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCC1=CC=CC=C1OC(=O)C2=C(C=CC(=C2)C(C)(C)C)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCCC1=CC=CC=C1OC(=O)C2=C(C=CC(=C2)C(C)(C)C)O

InChI

InChI=1S/C35H54O3/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-23-29-24-21-22-25-33(29)38-34(37)31-28-30(35(2,3)4)26-27-32(31)36/h21-22,24-28,36H,5-20,23H2,1-4H3