methyl 4-[2-[4-(phenylcarbonyl)pyridin-1-ium-1-yl]ethanoylamino]benzoate

Systemtic Name: methyl 4-[2-[4-(phenylcarbonyl)pyridin-1-ium-1-yl]ethanoylamino]benzoate Openeye Name: methyl 4-[[2-(4-benzoylpyridin-1-ium-1-yl)acetyl]amino]benzoate CAS Name: 4-[[2-(4-benzoyl-1-pyridin-1-iumyl)-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-(4-benzoylpyridin-1-ium-1-yl)acetyl]amino]benzoate Traditional Name: 4-[[2-(4-benzoylpyridin-1-ium-1-yl)acetyl]amino]benzoic acid methyl ester Formula: C22H19N2O4+ MolecularWeight: 375.39726

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H18N2O4/c1-28-22(27)18-7-9-19(10-8-18)23-20(25)15-24-13-11-17(12-14-24)21(26)16-5-3-2-4-6-16/h2-14H,15H2,1H3/p+1