N-[4-[4-[4-[1-(4-acetamidophenyl)-2,6-diphenyl-pyridin-1-ium-4-yl]phenyl]-2,6-diphenyl-pyridin-1-ium-1-yl]phenyl]ethanamide ditetrafluoroborate

Systemtic Name: N-[4-[4-[4-[1-(4-acetamidophenyl)-2,6-diphenyl-pyridin-1-ium-4-yl]phenyl]-2,6-diphenyl-pyridin-1-ium-1-yl]phenyl]ethanamide ditetrafluoroborate Openeye Name: N-[4-[4-[4-[1-(4-acetamidophenyl)-2,6-diphenyl-pyridin-1-ium-4-yl]phenyl]-2,6-diphenyl-pyridin-1-ium-1-yl]phenyl]acetamide ditetrafluoroborate CAS Name: N-[4-[4-[4-[1-(4-acetamidophenyl)-2,6-diphenyl-4-pyridin-1-iumyl]phenyl]-2,6-diphenyl-1-pyridin-1-iumyl]phenyl]acetamide ditetrafluoroborate IUPAC Name: N-[4-[4-[4-[1-(4-acetamidophenyl)-2,6-diphenylpyridin-1-ium-4-yl]phenyl]-2,6-diphenylpyridin-1-ium-1-yl]phenyl]acetamide ditetrafluoroborate Traditional Name: N-[4-[4-[4-[1-(4-acetamidophenyl)-2,6-diphenyl-pyridin-1-ium-4-yl]phenyl]-2,6-diphenyl-pyridin-1-ium-1-yl]phenyl]acetamide ditetrafluoroborate Formula: C56H44B2F8N4O2 MolecularWeight: 978.583386

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Descriptors Computed from Structure

Canonical SMILES:

[B-](F)(F)(F)F.[B-](F)(F)(F)F.CC(=O)NC1=CC=C(C=C1)[N+]2=C(C=C(C=C2C3=CC=CC=C3)C4=CC=C(C=C4)C5=CC(=[N+](C(=C5)C6=CC=CC=C6)C7=CC=C(C=C7)NC(=O)C)C8=CC=CC=C8)C9=CC=CC=C9

Isomeric SMILES

[B-](F)(F)(F)F.[B-](F)(F)(F)F.CC(=O)NC1=CC=C(C=C1)[N+]2=C(C=C(C=C2C3=CC=CC=C3)C4=CC=C(C=C4)C5=CC(=[N+](C(=C5)C6=CC=CC=C6)C7=CC=C(C=C7)NC(=O)C)C8=CC=CC=C8)C9=CC=CC=C9

InChI

InChI=1S/C56H42N4O2.2BF4/c1-39(61)57-49-27-31-51(32-28-49)59-53(43-15-7-3-8-16-43)35-47(36-54(59)44-17-9-4-10-18-44)41-23-25-42(26-24-41)48-37-55(45-19-11-5-12-20-45)60(56(38-48)46-21-13-6-14-22-46)52-33-29-50(30-34-52)58-40(2)62;2*2-1(3,4)5/h3-38H,1-2H3;;/q;2*-1/p+2