2,6-ditert-butyl-4-[[4-(3-oxidanylpropyl)piperazin-4-ium-1-yl]methyl]phenol

Systemtic Name: 2,6-ditert-butyl-4-[[4-(3-oxidanylpropyl)piperazin-4-ium-1-yl]methyl]phenol Openeye Name: 2,6-ditert-butyl-4-[[4-(3-hydroxypropyl)piperazin-4-ium-1-yl]methyl]phenol CAS Name: 2,6-ditert-butyl-4-[[4-(3-hydroxypropyl)-1-piperazin-4-iumyl]methyl]phenol IUPAC Name: 2,6-ditert-butyl-4-[[4-(3-hydroxypropyl)piperazin-4-ium-1-yl]methyl]phenol Traditional Name: 2,6-ditert-butyl-4-[[4-(3-hydroxypropyl)piperazin-4-ium-1-yl]methyl]phenol Formula: C22H39N2O2+ MolecularWeight: 363.55726

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CN2CC[NH+](CC2)CCCO

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CN2CC[NH+](CC2)CCCO

InChI

InChI=1S/C22H38N2O2/c1-21(2,3)18-14-17(15-19(20(18)26)22(4,5)6)16-24-11-9-23(10-12-24)8-7-13-25/h14-15,25-26H,7-13,16H2,1-6H3/p+1