4-(2,6-diphenylpyrylium-4-yl)-1-hexadecyl-pyridin-1-ium

Systemtic Name: 4-(2,6-diphenylpyrylium-4-yl)-1-hexadecyl-pyridin-1-ium Openeye Name: 4-(2,6-diphenylpyrylium-4-yl)-1-hexadecyl-pyridin-1-ium CAS Name: 4-(2,6-diphenyl-4-pyryliumyl)-1-hexadecylpyridin-1-ium IUPAC Name: 4-(2,6-diphenylpyrylium-4-yl)-1-hexadecylpyridin-1-ium Traditional Name: 1-cetyl-4-(2,6-diphenylpyrylium-4-yl)pyridin-1-ium Formula: C38H49NO+2 MolecularWeight: 535.80176

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC[N+]1=CC=C(C=C1)C2=CC(=[O+]C(=C2)C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CCCCCCCCCCCCCCCC[N+]1=CC=C(C=C1)C2=CC(=[O+]C(=C2)C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C38H49NO/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-21-28-39-29-26-33(27-30-39)36-31-37(34-22-17-15-18-23-34)40-38(32-36)35-24-19-16-20-25-35/h15-20,22-27,29-32H,2-14,21,28H2,1H3/q+2