ethyl 2-[4-[1-(2-ethoxy-2-oxidanylidene-ethyl)pyridin-1-ium-4-yl]pyridin-1-ium-1-yl]ethanoate dibromide

Systemtic Name: ethyl 2-[4-[1-(2-ethoxy-2-oxidanylidene-ethyl)pyridin-1-ium-4-yl]pyridin-1-ium-1-yl]ethanoate dibromide Openeye Name: ethyl 2-[4-[1-(2-ethoxy-2-oxo-ethyl)pyridin-1-ium-4-yl]pyridin-1-ium-1-yl]acetate dibromide CAS Name: 2-[4-[1-(2-ethoxy-2-oxoethyl)-4-pyridin-1-iumyl]-1-pyridin-1-iumyl]acetic acid ethyl ester dibromide IUPAC Name: ethyl 2-[4-[1-(2-ethoxy-2-oxoethyl)pyridin-1-ium-4-yl]pyridin-1-ium-1-yl]acetate dibromide Traditional Name: 2-[4-[1-(2-ethoxy-2-keto-ethyl)pyridin-1-ium-4-yl]pyridin-1-ium-1-yl]acetic acid ethyl ester dibromide Formula: C18H22Br2N2O4 MolecularWeight: 490.18628

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C[N+]1=CC=C(C=C1)C2=CC=[N+](C=C2)CC(=O)OCC.[Br-].[Br-]

Isomeric SMILES

CCOC(=O)C[N+]1=CC=C(C=C1)C2=CC=[N+](C=C2)CC(=O)OCC.[Br-].[Br-]

InChI

InChI=1S/C18H22N2O4.2BrH/c1-3-23-17(21)13-19-9-5-15(6-10-19)16-7-11-20(12-8-16)14-18(22)24-4-2;;/h5-12H,3-4,13-14H2,1-2H3;2*1H/q+2;;/p-2