methyl 2-[2-(3-phenylpyridin-1-ium-1-yl)ethanoylamino]benzoate

Systemtic Name: methyl 2-[2-(3-phenylpyridin-1-ium-1-yl)ethanoylamino]benzoate Openeye Name: methyl 2-[[2-(3-phenylpyridin-1-ium-1-yl)acetyl]amino]benzoate CAS Name: 2-[[1-oxo-2-(3-phenyl-1-pyridin-1-iumyl)ethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[[2-(3-phenylpyridin-1-ium-1-yl)acetyl]amino]benzoate Traditional Name: 2-[[2-(3-phenylpyridin-1-ium-1-yl)acetyl]amino]benzoic acid methyl ester Formula: C21H19N2O3+ MolecularWeight: 347.38716

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1NC(=O)C[N+]2=CC=CC(=C2)C3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=CC=CC=C1NC(=O)C[N+]2=CC=CC(=C2)C3=CC=CC=C3

InChI

InChI=1S/C21H18N2O3/c1-26-21(25)18-11-5-6-12-19(18)22-20(24)15-23-13-7-10-17(14-23)16-8-3-2-4-9-16/h2-14H,15H2,1H3/p+1