2-tert-butyl-6-[[4-[(3-tert-butyl-2-oxidanyl-phenyl)methyl]piperazin-1-ium-1-yl]methyl]phenol

Systemtic Name: 2-tert-butyl-6-[[4-[(3-tert-butyl-2-oxidanyl-phenyl)methyl]piperazin-1-ium-1-yl]methyl]phenol Openeye Name: 2-tert-butyl-6-[[4-[(3-tert-butyl-2-hydroxy-phenyl)methyl]piperazin-1-ium-1-yl]methyl]phenol CAS Name: 2-tert-butyl-6-[[4-[(3-tert-butyl-2-hydroxyphenyl)methyl]-1-piperazin-1-iumyl]methyl]phenol IUPAC Name: 2-tert-butyl-6-[[4-[(3-tert-butyl-2-hydroxyphenyl)methyl]piperazin-1-ium-1-yl]methyl]phenol Traditional Name: 2-tert-butyl-6-[[4-(3-tert-butyl-2-hydroxy-benzyl)piperazin-1-ium-1-yl]methyl]phenol Formula: C26H39N2O2+ MolecularWeight: 411.60006

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=CC(=C1O)C[NH+]2CCN(CC2)CC3=C(C(=CC=C3)C(C)(C)C)O

Isomeric SMILES

CC(C)(C)C1=CC=CC(=C1O)C[NH+]2CCN(CC2)CC3=C(C(=CC=C3)C(C)(C)C)O

InChI

InChI=1S/C26H38N2O2/c1-25(2,3)21-11-7-9-19(23(21)29)17-27-13-15-28(16-14-27)18-20-10-8-12-22(24(20)30)26(4,5)6/h7-12,29-30H,13-18H2,1-6H3/p+1