ethyl 4-[(1-oxidanidylpyridin-1-ium-3-yl)carbonylamino]benzoate hydrochloride

Systemtic Name: ethyl 4-[(1-oxidanidylpyridin-1-ium-3-yl)carbonylamino]benzoate hydrochloride Openeye Name: ethyl 4-[(1-oxidopyridin-1-ium-3-carbonyl)amino]benzoate hydrochloride CAS Name: 4-[[(1-oxido-3-pyridin-1-iumyl)-oxomethyl]amino]benzoic acid ethyl ester hydrochloride IUPAC Name: ethyl 4-[(1-oxidopyridin-1-ium-3-carbonyl)amino]benzoate hydrochloride Traditional Name: 4-[(1-oxidopyridin-1-ium-3-carbonyl)amino]benzoic acid ethyl ester hydrochloride Formula: C15H15ClN2O4 MolecularWeight: 322.7436

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)C2=C[N+](=CC=C2)[O-].Cl

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)C2=C[N+](=CC=C2)[O-].Cl

InChI

InChI=1S/C15H14N2O4.ClH/c1-2-21-15(19)11-5-7-13(8-6-11)16-14(18)12-4-3-9-17(20)10-12;/h3-10H,2H2,1H3,(H,16,18);1H