4-(3,5-ditert-butyl-4-oxidanyl-phenyl)sulfanylcyclohexane-1,2-dicarboxylic acid

Systemtic Name: 4-(3,5-ditert-butyl-4-oxidanyl-phenyl)sulfanylcyclohexane-1,2-dicarboxylic acid Openeye Name: 4-(3,5-ditert-butyl-4-hydroxy-phenyl)sulfanylcyclohexane-1,2-dicarboxylic acid CAS Name: 4-[(3,5-ditert-butyl-4-hydroxyphenyl)thio]cyclohexane-1,2-dicarboxylic acid IUPAC Name: 4-(3,5-ditert-butyl-4-hydroxyphenyl)sulfanylcyclohexane-1,2-dicarboxylic acid Traditional Name: 4-[(3,5-ditert-butyl-4-hydroxy-phenyl)thio]cyclohexane-1,2-dicarboxylic acid Formula: C22H32O5S MolecularWeight: 408.55148

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)SC2CCC(C(C2)C(=O)O)C(=O)O

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)SC2CCC(C(C2)C(=O)O)C(=O)O

InChI

InChI=1S/C22H32O5S/c1-21(2,3)16-10-13(11-17(18(16)23)22(4,5)6)28-12-7-8-14(19(24)25)15(9-12)20(26)27/h10-12,14-15,23H,7-9H2,1-6H3,(H,24,25)(H,26,27)