1-[(3,5-ditert-butyl-4-oxidanyl-phenyl)methyl]piperidin-4-ol; ethanedioic acid

Systemtic Name: 1-[(3,5-ditert-butyl-4-oxidanyl-phenyl)methyl]piperidin-4-ol; ethanedioic acid Openeye Name: 1-[(3,5-ditert-butyl-4-hydroxy-phenyl)methyl]piperidin-4-ol; oxalic acid CAS Name: 1-[(3,5-ditert-butyl-4-hydroxyphenyl)methyl]-4-piperidinol; oxalic acid IUPAC Name: 1-[(3,5-ditert-butyl-4-hydroxyphenyl)methyl]piperidin-4-ol; oxalic acid Traditional Name: 1-(3,5-ditert-butyl-4-hydroxy-benzyl)piperidin-4-ol; oxalic acid Formula: C22H35NO6 MolecularWeight: 409.5164

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CN2CCC(CC2)O.C(=O)(C(=O)O)O

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CN2CCC(CC2)O.C(=O)(C(=O)O)O

InChI

InChI=1S/C20H33NO2.C2H2O4/c1-19(2,3)16-11-14(12-17(18(16)23)20(4,5)6)13-21-9-7-15(22)8-10-21;3-1(4)2(5)6/h11-12,15,22-23H,7-10,13H2,1-6H3;(H,3,4)(H,5,6)