propyl 4-(2,4,6-triphenylpyridin-1-ium-1-yl)benzoate

Systemtic Name: propyl 4-(2,4,6-triphenylpyridin-1-ium-1-yl)benzoate Openeye Name: propyl 4-(2,4,6-triphenylpyridin-1-ium-1-yl)benzoate CAS Name: 4-(2,4,6-triphenyl-1-pyridin-1-iumyl)benzoic acid propyl ester IUPAC Name: propyl 4-(2,4,6-triphenylpyridin-1-ium-1-yl)benzoate Traditional Name: 4-(2,4,6-triphenylpyridin-1-ium-1-yl)benzoic acid propyl ester Formula: C33H28NO2+ MolecularWeight: 470.58092

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=CC=C(C=C1)[N+]2=C(C=C(C=C2C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CCCOC(=O)C1=CC=C(C=C1)[N+]2=C(C=C(C=C2C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C33H28NO2/c1-2-22-36-33(35)28-18-20-30(21-19-28)34-31(26-14-8-4-9-15-26)23-29(25-12-6-3-7-13-25)24-32(34)27-16-10-5-11-17-27/h3-21,23-24H,2,22H2,1H3/q+1