octadecyl 3,5-ditert-butylcyclohexa-1,5-diene-1-carboxylate

Systemtic Name: octadecyl 3,5-ditert-butylcyclohexa-1,5-diene-1-carboxylate Openeye Name: octadecyl 3,5-ditert-butylcyclohexa-1,5-diene-1-carboxylate CAS Name: 3,5-ditert-butyl-1-cyclohexa-1,5-dienecarboxylic acid octadecyl ester IUPAC Name: octadecyl 3,5-ditert-butylcyclohexa-1,5-diene-1-carboxylate Traditional Name: 3,5-ditert-butylcyclohexa-1,5-diene-1-carboxylic acid stearyl ester Formula: C33H60O2 MolecularWeight: 488.8283

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C33H60O2/c1-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-35-31(34)28-25-29(32(2,3)4)27-30(26-28)33(5,6)7/h25-26,29H,8-24,27H2,1-7H3