4-[[1-(5,5-dimethyl-6-oxidanyl-6-phenyl-hexyl)-1-oxidanidyl-piperidin-1-ium-4-yl]-phenyl-methyl]phenol

Systemtic Name: 4-[[1-(5,5-dimethyl-6-oxidanyl-6-phenyl-hexyl)-1-oxidanidyl-piperidin-1-ium-4-yl]-phenyl-methyl]phenol Openeye Name: 4-[[1-(6-hydroxy-5,5-dimethyl-6-phenyl-hexyl)-1-oxido-piperidin-1-ium-4-yl]-phenyl-methyl]phenol CAS Name: 4-[[1-(6-hydroxy-5,5-dimethyl-6-phenylhexyl)-1-oxido-4-piperidin-1-iumyl]-phenylmethyl]phenol IUPAC Name: 4-[[1-(6-hydroxy-5,5-dimethyl-6-phenylhexyl)-1-oxidopiperidin-1-ium-4-yl]-phenylmethyl]phenol Traditional Name: 4-[[1-(6-hydroxy-5,5-dimethyl-6-phenyl-hexyl)-1-oxido-piperidin-1-ium-4-yl]-phenyl-methyl]phenol Formula: C32H41NO3 MolecularWeight: 487.67284

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCCC[N+]1(CCC(CC1)C(C2=CC=CC=C2)C3=CC=C(C=C3)O)[O-])C(C4=CC=CC=C4)O

Isomeric SMILES

CC(C)(CCCC[N+]1(CCC(CC1)C(C2=CC=CC=C2)C3=CC=C(C=C3)O)[O-])C(C4=CC=CC=C4)O

InChI

InChI=1S/C32H41NO3/c1-32(2,31(35)28-13-7-4-8-14-28)21-9-10-22-33(36)23-19-27(20-24-33)30(25-11-5-3-6-12-25)26-15-17-29(34)18-16-26/h3-8,11-18,27,30-31,34-35H,9-10,19-24H2,1-2H3