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

Systemtic Name: 3-(2-methyl-4,6-diphenyl-pyridin-1-ium-1-yl)propanoic acid Openeye Name: 3-(2-methyl-4,6-diphenyl-pyridin-1-ium-1-yl)propanoic acid CAS Name: 3-(2-methyl-4,6-diphenyl-1-pyridin-1-iumyl)propanoic acid IUPAC Name: 3-(2-methyl-4,6-diphenylpyridin-1-ium-1-yl)propanoic acid Traditional Name: 3-(2-methyl-4,6-diphenyl-pyridin-1-ium-1-yl)propionic acid Formula: C21H20NO2+ MolecularWeight: 318.389

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=[N+]1CCC(=O)O)C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CC1=CC(=CC(=[N+]1CCC(=O)O)C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C21H19NO2/c1-16-14-19(17-8-4-2-5-9-17)15-20(18-10-6-3-7-11-18)22(16)13-12-21(23)24/h2-11,14-15H,12-13H2,1H3/p+1