butyl 4-[2-(4-ethylpyridin-1-ium-1-yl)ethanoylamino]benzoate

Systemtic Name: butyl 4-[2-(4-ethylpyridin-1-ium-1-yl)ethanoylamino]benzoate Openeye Name: butyl 4-[[2-(4-ethylpyridin-1-ium-1-yl)acetyl]amino]benzoate CAS Name: 4-[[2-(4-ethyl-1-pyridin-1-iumyl)-1-oxoethyl]amino]benzoic acid butyl ester IUPAC Name: butyl 4-[[2-(4-ethylpyridin-1-ium-1-yl)acetyl]amino]benzoate Traditional Name: 4-[[2-(4-ethylpyridin-1-ium-1-yl)acetyl]amino]benzoic acid butyl ester Formula: C20H25N2O3+ MolecularWeight: 341.4241

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H24N2O3/c1-3-5-14-25-20(24)17-6-8-18(9-7-17)21-19(23)15-22-12-10-16(4-2)11-13-22/h6-13H,3-5,14-15H2,1-2H3/p+1