2-[(3,5-ditert-butyl-4-oxidanyl-phenyl)methyl]-3-ethyl-octadecanoate

Systemtic Name: 2-[(3,5-ditert-butyl-4-oxidanyl-phenyl)methyl]-3-ethyl-octadecanoate Openeye Name: 2-[(3,5-ditert-butyl-4-hydroxy-phenyl)methyl]-3-ethyl-octadecanoate CAS Name: 2-[(3,5-ditert-butyl-4-hydroxyphenyl)methyl]-3-ethyloctadecanoate IUPAC Name: 2-[(3,5-ditert-butyl-4-hydroxyphenyl)methyl]-3-ethyloctadecanoate Traditional Name: 2-(3,5-ditert-butyl-4-hydroxy-benzyl)-3-ethyl-stearate Formula: C35H61O3- MolecularWeight: 529.85704

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(CC)C(CC1=CC(=C(C(=C1)C(C)(C)C)O)C(C)(C)C)C(=O)[O-]

Isomeric SMILES

CCCCCCCCCCCCCCCC(CC)C(CC1=CC(=C(C(=C1)C(C)(C)C)O)C(C)(C)C)C(=O)[O-]

InChI

InChI=1S/C35H62O3/c1-9-11-12-13-14-15-16-17-18-19-20-21-22-23-28(10-2)29(33(37)38)24-27-25-30(34(3,4)5)32(36)31(26-27)35(6,7)8/h25-26,28-29,36H,9-24H2,1-8H3,(H,37,38)/p-1