4-[6-azanyl-3-(3-chlorophenyl)-5-methyl-pyridazin-1-ium-1-yl]butanoic acid

Systemtic Name: 4-[6-azanyl-3-(3-chlorophenyl)-5-methyl-pyridazin-1-ium-1-yl]butanoic acid Openeye Name: 4-[6-amino-3-(3-chlorophenyl)-5-methyl-pyridazin-1-ium-1-yl]butanoic acid CAS Name: 4-[6-amino-3-(3-chlorophenyl)-5-methyl-1-pyridazin-1-iumyl]butanoic acid IUPAC Name: 4-[6-amino-3-(3-chlorophenyl)-5-methylpyridazin-1-ium-1-yl]butanoic acid Traditional Name: 4-[6-amino-3-(3-chlorophenyl)-5-methyl-pyridazin-1-ium-1-yl]butyric acid Formula: C15H17ClN3O2+ MolecularWeight: 306.76738

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=N[N+](=C1N)CCCC(=O)O)C2=CC(=CC=C2)Cl

Isomeric SMILES

CC1=CC(=N[N+](=C1N)CCCC(=O)O)C2=CC(=CC=C2)Cl

InChI

InChI=1S/C15H16ClN3O2/c1-10-8-13(11-4-2-5-12(16)9-11)18-19(15(10)17)7-3-6-14(20)21/h2,4-5,8-9,17H,3,6-7H2,1H3,(H,20,21)/p+1