ethyl 8-oxidanylidene-1-(phenylmethyl)-5H-imidazo[1,2-b]pyridazin-1-ium-7-carboxylate

Systemtic Name: ethyl 8-oxidanylidene-1-(phenylmethyl)-5H-imidazo[1,2-b]pyridazin-1-ium-7-carboxylate Openeye Name: ethyl 1-benzyl-8-oxo-5H-imidazo[1,2-b]pyridazin-1-ium-7-carboxylate CAS Name: 8-oxo-1-(phenylmethyl)-5H-imidazo[1,2-b]pyridazin-1-ium-7-carboxylic acid ethyl ester IUPAC Name: ethyl 1-benzyl-8-oxo-5H-imidazo[1,2-b]pyridazin-1-ium-7-carboxylate Traditional Name: 1-benzyl-8-keto-5H-imidazo[1,2-b]pyridazin-1-ium-7-carboxylic acid ethyl ester Formula: C16H16N3O3+ MolecularWeight: 298.31654

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CNN2C=C[N+](=C2C1=O)CC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=CNN2C=C[N+](=C2C1=O)CC3=CC=CC=C3

InChI

InChI=1S/C16H15N3O3/c1-2-22-16(21)13-10-17-19-9-8-18(15(19)14(13)20)11-12-6-4-3-5-7-12/h3-10H,2,11H2,1H3/p+1