3,5-ditert-butyl-4-(3,5-ditert-butyl-4-oxidanyl-phenyl)carbonyloxy-benzenecarbothioic S-acid

Systemtic Name: 3,5-ditert-butyl-4-(3,5-ditert-butyl-4-oxidanyl-phenyl)carbonyloxy-benzenecarbothioic S-acid Openeye Name: 3,5-ditert-butyl-4-(3,5-ditert-butyl-4-hydroxy-benzoyl)oxy-benzenecarbothioic S-acid CAS Name: 3,5-ditert-butyl-4-[(3,5-ditert-butyl-4-hydroxyphenyl)-oxomethoxy]benzenecarbothioic S-acid IUPAC Name: 3,5-ditert-butyl-4-(3,5-ditert-butyl-4-hydroxybenzoyl)oxybenzenecarbothioic S-acid Traditional Name: 3,5-ditert-butyl-4-(3,5-ditert-butyl-4-hydroxy-benzoyl)oxy-thiobenzoic acid Formula: C30H42O4S MolecularWeight: 498.71708

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C(=O)OC2=C(C=C(C=C2C(C)(C)C)C(=O)S)C(C)(C)C

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C(=O)OC2=C(C=C(C=C2C(C)(C)C)C(=O)S)C(C)(C)C

InChI

InChI=1S/C30H42O4S/c1-27(2,3)19-13-17(14-20(23(19)31)28(4,5)6)25(32)34-24-21(29(7,8)9)15-18(26(33)35)16-22(24)30(10,11)12/h13-16,31H,1-12H3,(H,33,35)