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

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

Systemtic Name:2-[(3,5-ditert-butyl-4-oxidanyl-phenyl)methyl]hexadecanoate
Openeye Name:2-[(3,5-ditert-butyl-4-hydroxy-phenyl)methyl]hexadecanoate
CAS Name:2-[(3,5-ditert-butyl-4-hydroxyphenyl)methyl]hexadecanoate
IUPAC Name:2-[(3,5-ditert-butyl-4-hydroxyphenyl)methyl]hexadecanoate
Traditional Name:2-(3,5-ditert-butyl-4-hydroxy-benzyl)palmitate
Formula: C31H53O3-
MolecularWeight: 473.75072
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C31H54O3/c1-8-9-10-11-12-13-14-15-16-17-18-19-20-25(29(33)34)21-24-22-26(30(2,3)4)28(32)27(23-24)31(5,6)7/h22-23,25,32H,8-21H2,1-7H3,(H,33,34)/p-1


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