ethyl 2-oxidanylidene-2-[[3-(2-pyridin-1-ium-1-ylethanoyl)phenyl]amino]ethanoate bromide

Systemtic Name: ethyl 2-oxidanylidene-2-[[3-(2-pyridin-1-ium-1-ylethanoyl)phenyl]amino]ethanoate bromide Openeye Name: ethyl 2-oxo-2-[3-(2-pyridin-1-ium-1-ylacetyl)anilino]acetate bromide CAS Name: 2-oxo-2-[3-[1-oxo-2-(1-pyridin-1-iumyl)ethyl]anilino]acetic acid ethyl ester bromide IUPAC Name: ethyl 2-oxo-2-[3-(2-pyridin-1-ium-1-ylacetyl)anilino]acetate bromide Traditional Name: 2-keto-2-[3-(2-pyridin-1-ium-1-ylacetyl)anilino]acetic acid ethyl ester bromide Formula: C17H17BrN2O4 MolecularWeight: 393.23188

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=O)NC1=CC=CC(=C1)C(=O)C[N+]2=CC=CC=C2.[Br-]

Isomeric SMILES

CCOC(=O)C(=O)NC1=CC=CC(=C1)C(=O)C[N+]2=CC=CC=C2.[Br-]

InChI

InChI=1S/C17H16N2O4.BrH/c1-2-23-17(22)16(21)18-14-8-6-7-13(11-14)15(20)12-19-9-4-3-5-10-19;/h3-11H,2,12H2,1H3;1H