octadecyl 3,5-ditert-butyl-2-oxidanyl-benzoate

Systemtic Name: octadecyl 3,5-ditert-butyl-2-oxidanyl-benzoate Openeye Name: octadecyl 3,5-ditert-butyl-2-hydroxy-benzoate CAS Name: 3,5-ditert-butyl-2-hydroxybenzoic acid octadecyl ester IUPAC Name: octadecyl 3,5-ditert-butyl-2-hydroxybenzoate Traditional Name: 3,5-ditert-butyl-2-hydroxy-benzoic acid stearyl ester Formula: C33H58O3 MolecularWeight: 502.81182

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOC(=O)C1=CC(=CC(=C1O)C(C)(C)C)C(C)(C)C

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOC(=O)C1=CC(=CC(=C1O)C(C)(C)C)C(C)(C)C

InChI

InChI=1S/C33H58O3/c1-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-36-31(35)28-25-27(32(2,3)4)26-29(30(28)34)33(5,6)7/h25-26,34H,8-24H2,1-7H3