2,6-bis(4-tert-butylphenyl)-4-[2,4,6-tris(4-tert-butylphenyl)pyridin-1-ium-1-yl]phenol

Systemtic Name: 2,6-bis(4-tert-butylphenyl)-4-[2,4,6-tris(4-tert-butylphenyl)pyridin-1-ium-1-yl]phenol Openeye Name: 2,6-bis(4-tert-butylphenyl)-4-[2,4,6-tris(4-tert-butylphenyl)pyridin-1-ium-1-yl]phenol CAS Name: 2,6-bis(4-tert-butylphenyl)-4-[2,4,6-tris(4-tert-butylphenyl)-1-pyridin-1-iumyl]phenol IUPAC Name: 2,6-bis(4-tert-butylphenyl)-4-[2,4,6-tris(4-tert-butylphenyl)pyridin-1-ium-1-yl]phenol Traditional Name: 2,6-bis(4-tert-butylphenyl)-4-[2,4,6-tris(4-tert-butylphenyl)pyridin-1-ium-1-yl]phenol Formula: C61H70NO+ MolecularWeight: 833.2146

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2=CC(=[N+](C(=C2)C3=CC=C(C=C3)C(C)(C)C)C4=CC(=C(C(=C4)C5=CC=C(C=C5)C(C)(C)C)O)C6=CC=C(C=C6)C(C)(C)C)C7=CC=C(C=C7)C(C)(C)C

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2=CC(=[N+](C(=C2)C3=CC=C(C=C3)C(C)(C)C)C4=CC(=C(C(=C4)C5=CC=C(C=C5)C(C)(C)C)O)C6=CC=C(C=C6)C(C)(C)C)C7=CC=C(C=C7)C(C)(C)C

InChI

InChI=1S/C61H69NO/c1-57(2,3)46-26-16-40(17-27-46)45-36-54(43-22-32-49(33-23-43)60(10,11)12)62(55(37-45)44-24-34-50(35-25-44)61(13,14)15)51-38-52(41-18-28-47(29-19-41)58(4,5)6)56(63)53(39-51)42-20-30-48(31-21-42)59(7,8)9/h16-39H,1-15H3/p+1