3,5-bis(2-methylheptan-2-yl)-4-oxidanyl-benzoic acid

Systemtic Name: 3,5-bis(2-methylheptan-2-yl)-4-oxidanyl-benzoic acid Openeye Name: 3,5-bis(1,1-dimethylhexyl)-4-hydroxy-benzoic acid CAS Name: 4-hydroxy-3,5-bis(2-methylheptan-2-yl)benzoic acid IUPAC Name: 4-hydroxy-3,5-bis(2-methylheptan-2-yl)benzoic acid Traditional Name: 3,5-bis(1,1-dimethylhexyl)-4-hydroxy-benzoic acid Formula: C23H38O3 MolecularWeight: 362.54602

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)(C)C1=CC(=CC(=C1O)C(C)(C)CCCCC)C(=O)O

Isomeric SMILES

CCCCCC(C)(C)C1=CC(=CC(=C1O)C(C)(C)CCCCC)C(=O)O

InChI

InChI=1S/C23H38O3/c1-7-9-11-13-22(3,4)18-15-17(21(25)26)16-19(20(18)24)23(5,6)14-12-10-8-2/h15-16,24H,7-14H2,1-6H3,(H,25,26)