ethyl 4-(6-azanyl-5-methyl-3-phenyl-pyridazin-1-ium-1-yl)butanoate

Systemtic Name: ethyl 4-(6-azanyl-5-methyl-3-phenyl-pyridazin-1-ium-1-yl)butanoate Openeye Name: ethyl 4-(6-amino-5-methyl-3-phenyl-pyridazin-1-ium-1-yl)butanoate CAS Name: 4-(6-amino-5-methyl-3-phenyl-1-pyridazin-1-iumyl)butanoic acid ethyl ester IUPAC Name: ethyl 4-(6-amino-5-methyl-3-phenylpyridazin-1-ium-1-yl)butanoate Traditional Name: 4-(6-amino-5-methyl-3-phenyl-pyridazin-1-ium-1-yl)butyric acid ethyl ester Formula: C17H22N3O2+ MolecularWeight: 300.37548

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC[N+]1=C(C(=CC(=N1)C2=CC=CC=C2)C)N

Isomeric SMILES

CCOC(=O)CCC[N+]1=C(C(=CC(=N1)C2=CC=CC=C2)C)N

InChI

InChI=1S/C17H21N3O2/c1-3-22-16(21)10-7-11-20-17(18)13(2)12-15(19-20)14-8-5-4-6-9-14/h4-6,8-9,12,18H,3,7,10-11H2,1-2H3/p+1