ethyl 1-[2-[6,8-bis(bromanyl)-2-oxidanylidene-chromen-3-yl]-2-oxidanylidene-ethyl]pyridin-1-ium-3-carboxylate

Systemtic Name: ethyl 1-[2-[6,8-bis(bromanyl)-2-oxidanylidene-chromen-3-yl]-2-oxidanylidene-ethyl]pyridin-1-ium-3-carboxylate Openeye Name: ethyl 1-[2-(6,8-dibromo-2-oxo-chromen-3-yl)-2-oxo-ethyl]pyridin-1-ium-3-carboxylate CAS Name: 1-[2-(6,8-dibromo-2-oxo-1-benzopyran-3-yl)-2-oxoethyl]-3-pyridin-1-iumcarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-(6,8-dibromo-2-oxochromen-3-yl)-2-oxoethyl]pyridin-1-ium-3-carboxylate Traditional Name: 1-[2-(6,8-dibromo-2-keto-chromen-3-yl)-2-keto-ethyl]pyridin-1-ium-3-carboxylic acid ethyl ester Formula: C19H14Br2NO5+ MolecularWeight: 496.12616

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C[N+](=CC=C1)CC(=O)C2=CC3=CC(=CC(=C3OC2=O)Br)Br

Isomeric SMILES

CCOC(=O)C1=C[N+](=CC=C1)CC(=O)C2=CC3=CC(=CC(=C3OC2=O)Br)Br

InChI

InChI=1S/C19H14Br2NO5/c1-2-26-18(24)11-4-3-5-22(9-11)10-16(23)14-7-12-6-13(20)8-15(21)17(12)27-19(14)25/h3-9H,2,10H2,1H3/q+1