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

Systemtic Name: 2,6-ditert-butyl-4-[(4-phenyl-1,2,3,6-tetrahydropyridin-1-ium-1-yl)methyl]phenol Openeye Name: 2,6-ditert-butyl-4-[(4-phenyl-1,2,3,6-tetrahydropyridin-1-ium-1-yl)methyl]phenol CAS Name: 2,6-ditert-butyl-4-[(4-phenyl-1,2,3,6-tetrahydropyridin-1-ium-1-yl)methyl]phenol IUPAC Name: 2,6-ditert-butyl-4-[(4-phenyl-1,2,3,6-tetrahydropyridin-1-ium-1-yl)methyl]phenol Traditional Name: 2,6-ditert-butyl-4-[(4-phenyl-1,2,3,6-tetrahydropyridin-1-ium-1-yl)methyl]phenol Formula: C26H36NO+ MolecularWeight: 378.57014

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C[NH+]2CCC(=CC2)C3=CC=CC=C3

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C[NH+]2CCC(=CC2)C3=CC=CC=C3

InChI

InChI=1S/C26H35NO/c1-25(2,3)22-16-19(17-23(24(22)28)26(4,5)6)18-27-14-12-21(13-15-27)20-10-8-7-9-11-20/h7-12,16-17,28H,13-15,18H2,1-6H3/p+1