3-(2-ethyl-4,6-diphenyl-pyridin-1-ium-1-yl)propanoic acid

Systemtic Name: 3-(2-ethyl-4,6-diphenyl-pyridin-1-ium-1-yl)propanoic acid Openeye Name: 3-(2-ethyl-4,6-diphenyl-pyridin-1-ium-1-yl)propanoic acid CAS Name: 3-(2-ethyl-4,6-diphenyl-1-pyridin-1-iumyl)propanoic acid IUPAC Name: 3-(2-ethyl-4,6-diphenylpyridin-1-ium-1-yl)propanoic acid Traditional Name: 3-(2-ethyl-4,6-diphenyl-pyridin-1-ium-1-yl)propionic acid Formula: C22H22NO2+ MolecularWeight: 332.41558

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC(=[N+]1CCC(=O)O)C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CCC1=CC(=CC(=[N+]1CCC(=O)O)C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C22H21NO2/c1-2-20-15-19(17-9-5-3-6-10-17)16-21(18-11-7-4-8-12-18)23(20)14-13-22(24)25/h3-12,15-16H,2,13-14H2,1H3/p+1