8-[(3,5-ditert-butyl-2-oxidanyl-phenyl)amino]-8-oxidanylidene-octanoic acid

Systemtic Name: 8-[(3,5-ditert-butyl-2-oxidanyl-phenyl)amino]-8-oxidanylidene-octanoic acid Openeye Name: 8-(3,5-ditert-butyl-2-hydroxy-anilino)-8-oxo-octanoic acid CAS Name: 8-(3,5-ditert-butyl-2-hydroxyanilino)-8-oxooctanoic acid IUPAC Name: 8-(3,5-ditert-butyl-2-hydroxyanilino)-8-oxooctanoic acid Traditional Name: 8-(3,5-ditert-butyl-2-hydroxy-anilino)-8-keto-caprylic acid Formula: C22H35NO4 MolecularWeight: 377.5176

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(C(=C1)NC(=O)CCCCCCC(=O)O)O)C(C)(C)C

Isomeric SMILES

CC(C)(C)C1=CC(=C(C(=C1)NC(=O)CCCCCCC(=O)O)O)C(C)(C)C

InChI

InChI=1S/C22H35NO4/c1-21(2,3)15-13-16(22(4,5)6)20(27)17(14-15)23-18(24)11-9-7-8-10-12-19(25)26/h13-14,27H,7-12H2,1-6H3,(H,23,24)(H,25,26)