4-hexadecyl-2-(1-hexadecyl-4-methyl-pyridin-1-ium-3-yl)-1H-imidazo[4,5-b]pyridin-4-ium

Systemtic Name: 4-hexadecyl-2-(1-hexadecyl-4-methyl-pyridin-1-ium-3-yl)-1H-imidazo[4,5-b]pyridin-4-ium Openeye Name: 4-hexadecyl-2-(1-hexadecyl-4-methyl-pyridin-1-ium-3-yl)-1H-imidazo[4,5-b]pyridin-4-ium CAS Name: 4-hexadecyl-2-(1-hexadecyl-4-methyl-3-pyridin-1-iumyl)-1H-imidazo[4,5-b]pyridin-4-ium IUPAC Name: 4-hexadecyl-2-(1-hexadecyl-4-methylpyridin-1-ium-3-yl)-1H-imidazo[4,5-b]pyridin-4-ium Traditional Name: 4-cetyl-2-(1-cetyl-4-methyl-pyridin-1-ium-3-yl)-1H-imidazo[4,5-b]pyridin-4-ium Formula: C44H76N4+2 MolecularWeight: 661.10104

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC[N+]1=CC(=C(C=C1)C)C2=NC3=C(N2)C=CC=[N+]3CCCCCCCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCC[N+]1=CC(=C(C=C1)C)C2=NC3=C(N2)C=CC=[N+]3CCCCCCCCCCCCCCCC

InChI

InChI=1S/C44H75N4/c1-4-6-8-10-12-14-16-18-20-22-24-26-28-30-35-47-38-34-40(3)41(39-47)43-45-42-33-32-37-48(44(42)46-43)36-31-29-27-25-23-21-19-17-15-13-11-9-7-5-2/h32-34,37-39H,4-31,35-36H2,1-3H3/q+1/p+1