2,6-ditert-butyl-4-[(R)-piperidin-1-ium-1-yl(pyridin-2-yl)methyl]phenol

Systemtic Name: 2,6-ditert-butyl-4-[(R)-piperidin-1-ium-1-yl(pyridin-2-yl)methyl]phenol Openeye Name: 2,6-ditert-butyl-4-[(R)-piperidin-1-ium-1-yl(2-pyridyl)methyl]phenol CAS Name: 2,6-ditert-butyl-4-[(R)-1-piperidin-1-iumyl(2-pyridinyl)methyl]phenol IUPAC Name: 2,6-ditert-butyl-4-[(R)-piperidin-1-ium-1-yl(pyridin-2-yl)methyl]phenol Traditional Name: 2,6-ditert-butyl-4-[(R)-piperidin-1-ium-1-yl(2-pyridyl)methyl]phenol Formula: C25H37N2O+ MolecularWeight: 381.57408

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C(C2=CC=CC=N2)[NH+]3CCCCC3

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)[C@H](C2=CC=CC=N2)[NH+]3CCCCC3

InChI

InChI=1S/C25H36N2O/c1-24(2,3)19-16-18(17-20(23(19)28)25(4,5)6)22(21-12-8-9-13-26-21)27-14-10-7-11-15-27/h8-9,12-13,16-17,22,28H,7,10-11,14-15H2,1-6H3/p+1/t22-/m1/s1