5-[2-(3,5-ditert-butyl-4-oxidanyl-phenyl)-2-methyl-3-oxidanylidene-thiomorpholin-4-yl]pentanoic acid

Systemtic Name: 5-[2-(3,5-ditert-butyl-4-oxidanyl-phenyl)-2-methyl-3-oxidanylidene-thiomorpholin-4-yl]pentanoic acid Openeye Name: 5-[2-(3,5-ditert-butyl-4-hydroxy-phenyl)-2-methyl-3-oxo-thiomorpholin-4-yl]pentanoic acid CAS Name: 5-[2-(3,5-ditert-butyl-4-hydroxyphenyl)-2-methyl-3-oxo-4-thiomorpholinyl]pentanoic acid IUPAC Name: 5-[2-(3,5-ditert-butyl-4-hydroxyphenyl)-2-methyl-3-oxothiomorpholin-4-yl]pentanoic acid Traditional Name: 5-[2-(3,5-ditert-butyl-4-hydroxy-phenyl)-3-keto-2-methyl-thiomorpholin-4-yl]valeric acid Formula: C24H37NO4S MolecularWeight: 435.61988

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=O)N(CCS1)CCCCC(=O)O)C2=CC(=C(C(=C2)C(C)(C)C)O)C(C)(C)C

Isomeric SMILES

CC1(C(=O)N(CCS1)CCCCC(=O)O)C2=CC(=C(C(=C2)C(C)(C)C)O)C(C)(C)C

InChI

InChI=1S/C24H37NO4S/c1-22(2,3)17-14-16(15-18(20(17)28)23(4,5)6)24(7)21(29)25(12-13-30-24)11-9-8-10-19(26)27/h14-15,28H,8-13H2,1-7H3,(H,26,27)