4-[6-azanyl-3-(2-methylpropyl)pyridazin-1-ium-1-yl]butanoic acid

Systemtic Name: 4-[6-azanyl-3-(2-methylpropyl)pyridazin-1-ium-1-yl]butanoic acid Openeye Name: 4-(6-amino-3-isobutyl-pyridazin-1-ium-1-yl)butanoic acid CAS Name: 4-[6-amino-3-(2-methylpropyl)-1-pyridazin-1-iumyl]butanoic acid IUPAC Name: 4-[6-amino-3-(2-methylpropyl)pyridazin-1-ium-1-yl]butanoic acid Traditional Name: 4-(6-amino-3-isobutyl-pyridazin-1-ium-1-yl)butyric acid Formula: C12H20N3O2+ MolecularWeight: 238.3061

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=N[N+](=C(C=C1)N)CCCC(=O)O

Isomeric SMILES

CC(C)CC1=N[N+](=C(C=C1)N)CCCC(=O)O

InChI

InChI=1S/C12H19N3O2/c1-9(2)8-10-5-6-11(13)15(14-10)7-3-4-12(16)17/h5-6,9,13H,3-4,7-8H2,1-2H3,(H,16,17)/p+1