2,2-bis(3,5-ditert-butyl-4-oxidanyl-phenyl)hexanedioate; 2-(3,5-ditert-butyl-4-oxidanyl-phenyl)octadecanoate

Systemtic Name: 2,2-bis(3,5-ditert-butyl-4-oxidanyl-phenyl)hexanedioate; 2-(3,5-ditert-butyl-4-oxidanyl-phenyl)octadecanoate Openeye Name: 2,2-bis(3,5-ditert-butyl-4-hydroxy-phenyl)hexanedioate; 2-(3,5-ditert-butyl-4-hydroxy-phenyl)octadecanoate CAS Name: 2,2-bis(3,5-ditert-butyl-4-hydroxyphenyl)hexanedioate; 2-(3,5-ditert-butyl-4-hydroxyphenyl)octadecanoate IUPAC Name: 2,2-bis(3,5-ditert-butyl-4-hydroxyphenyl)hexanedioate; 2-(3,5-ditert-butyl-4-hydroxyphenyl)octadecanoate Traditional Name: 2,2-bis(3,5-ditert-butyl-4-hydroxy-phenyl)adipate; 2-(3,5-ditert-butyl-4-hydroxy-phenyl)stearate Formula: C66H103O9-3 MolecularWeight: 1040.51862

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCC(C1=CC(=C(C(=C1)C(C)(C)C)O)C(C)(C)C)C(=O)[O-].CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C(CCCC(=O)[O-])(C2=CC(=C(C(=C2)C(C)(C)C)O)C(C)(C)C)C(=O)[O-]

Isomeric SMILES

CCCCCCCCCCCCCCCCC(C1=CC(=C(C(=C1)C(C)(C)C)O)C(C)(C)C)C(=O)[O-].CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C(CCCC(=O)[O-])(C2=CC(=C(C(=C2)C(C)(C)C)O)C(C)(C)C)C(=O)[O-]

InChI

InChI=1S/C34H50O6.C32H56O3/c1-30(2,3)22-16-20(17-23(27(22)37)31(4,5)6)34(29(39)40,15-13-14-26(35)36)21-18-24(32(7,8)9)28(38)25(19-21)33(10,11)12;1-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-26(30(34)35)25-23-27(31(2,3)4)29(33)28(24-25)32(5,6)7/h16-19,37-38H,13-15H2,1-12H3,(H,35,36)(H,39,40);23-24,26,33H,8-22H2,1-7H3,(H,34,35)/p-3