2,6-ditert-butyl-4-[(2S)-2-oxidanyl-3-piperidin-1-ium-1-yl-propoxy]phenol

Systemtic Name: 2,6-ditert-butyl-4-[(2S)-2-oxidanyl-3-piperidin-1-ium-1-yl-propoxy]phenol Openeye Name: 2,6-ditert-butyl-4-[(2S)-2-hydroxy-3-piperidin-1-ium-1-yl-propoxy]phenol CAS Name: 2,6-ditert-butyl-4-[(2S)-2-hydroxy-3-(1-piperidin-1-iumyl)propoxy]phenol IUPAC Name: 2,6-ditert-butyl-4-[(2S)-2-hydroxy-3-piperidin-1-ium-1-ylpropoxy]phenol Traditional Name: 2,6-ditert-butyl-4-[(2S)-2-hydroxy-3-piperidin-1-ium-1-yl-propoxy]phenol Formula: C22H38NO3+ MolecularWeight: 364.54202

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)OCC(C[NH+]2CCCCC2)O

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)OC[C@H](C[NH+]2CCCCC2)O

InChI

InChI=1S/C22H37NO3/c1-21(2,3)18-12-17(13-19(20(18)25)22(4,5)6)26-15-16(24)14-23-10-8-7-9-11-23/h12-13,16,24-25H,7-11,14-15H2,1-6H3/p+1/t16-/m0/s1