(2,3-ditert-butyl-4-oxidanyl-phenyl) octadecanoate

Systemtic Name: (2,3-ditert-butyl-4-oxidanyl-phenyl) octadecanoate Openeye Name: (2,3-ditert-butyl-4-hydroxy-phenyl) octadecanoate CAS Name: octadecanoic acid (2,3-ditert-butyl-4-hydroxyphenyl) ester IUPAC Name: (2,3-ditert-butyl-4-hydroxyphenyl) octadecanoate Traditional Name: stearic acid (2,3-ditert-butyl-4-hydroxy-phenyl) ester Formula: C32H56O3 MolecularWeight: 488.78524

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)OC1=C(C(=C(C=C1)O)C(C)(C)C)C(C)(C)C

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)OC1=C(C(=C(C=C1)O)C(C)(C)C)C(C)(C)C

InChI

InChI=1S/C32H56O3/c1-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-28(34)35-27-25-24-26(33)29(31(2,3)4)30(27)32(5,6)7/h24-25,33H,8-23H2,1-7H3