ethyl 3-[5-(ethoxymethylideneamino)-6-methoxy-2-oxidanidyl-pyridazin-2-ium-4-yl]-2-oxidanylidene-propanoate

Systemtic Name: ethyl 3-[5-(ethoxymethylideneamino)-6-methoxy-2-oxidanidyl-pyridazin-2-ium-4-yl]-2-oxidanylidene-propanoate Openeye Name: ethyl 3-[5-(ethoxymethyleneamino)-6-methoxy-2-oxido-pyridazin-2-ium-4-yl]-2-oxo-propanoate CAS Name: 3-[5-(ethoxymethylideneamino)-6-methoxy-2-oxido-4-pyridazin-2-iumyl]-2-oxopropanoic acid ethyl ester IUPAC Name: ethyl 3-[5-(ethoxymethylideneamino)-6-methoxy-2-oxidopyridazin-2-ium-4-yl]-2-oxopropanoate Traditional Name: 3-[5-(ethoxymethyleneamino)-6-methoxy-2-oxido-pyridazin-2-ium-4-yl]-2-keto-propionic acid ethyl ester Formula: C13H17N3O6 MolecularWeight: 311.29058

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Descriptors Computed from Structure

Canonical SMILES:

CCOC=NC1=C(N=[N+](C=C1CC(=O)C(=O)OCC)[O-])OC

Isomeric SMILES

CCOC=NC1=C(N=[N+](C=C1CC(=O)C(=O)OCC)[O-])OC

InChI

InChI=1S/C13H17N3O6/c1-4-21-8-14-11-9(6-10(17)13(18)22-5-2)7-16(19)15-12(11)20-3/h7-8H,4-6H2,1-3H3