3,5-ditert-butyl-4-[5-(2,6-ditert-butylphenoxy)-1-oxidanyl-1-oxidanylidene-pentan-2-yl]oxy-benzoic acid

Systemtic Name: 3,5-ditert-butyl-4-[5-(2,6-ditert-butylphenoxy)-1-oxidanyl-1-oxidanylidene-pentan-2-yl]oxy-benzoic acid Openeye Name: 3,5-ditert-butyl-4-[1-carboxy-4-(2,6-ditert-butylphenoxy)butoxy]benzoic acid CAS Name: 3,5-ditert-butyl-4-[5-(2,6-ditert-butylphenoxy)-1-hydroxy-1-oxopentan-2-yl]oxybenzoic acid IUPAC Name: 3,5-ditert-butyl-4-[5-(2,6-ditert-butylphenoxy)-1-hydroxy-1-oxopentan-2-yl]oxybenzoic acid Traditional Name: 3,5-ditert-butyl-4-[1-carboxy-4-(2,6-ditert-butylphenoxy)butoxy]benzoic acid Formula: C34H50O6 MolecularWeight: 554.7572

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C(C(=CC=C1)C(C)(C)C)OCCCC(C(=O)O)OC2=C(C=C(C=C2C(C)(C)C)C(=O)O)C(C)(C)C

Isomeric SMILES

CC(C)(C)C1=C(C(=CC=C1)C(C)(C)C)OCCCC(C(=O)O)OC2=C(C=C(C=C2C(C)(C)C)C(=O)O)C(C)(C)C

InChI

InChI=1S/C34H50O6/c1-31(2,3)22-15-13-16-23(32(4,5)6)27(22)39-18-14-17-26(30(37)38)40-28-24(33(7,8)9)19-21(29(35)36)20-25(28)34(10,11)12/h13,15-16,19-20,26H,14,17-18H2,1-12H3,(H,35,36)(H,37,38)