(2S)-2-azanyl-4-pyridazin-1-ium-1-yl-butanoic acid bromide

Systemtic Name: (2S)-2-azanyl-4-pyridazin-1-ium-1-yl-butanoic acid bromide Openeye Name: (2S)-2-amino-4-pyridazin-1-ium-1-yl-butanoic acid bromide CAS Name: (2S)-2-amino-4-(1-pyridazin-1-iumyl)butanoic acid bromide IUPAC Name: (2S)-2-amino-4-pyridazin-1-ium-1-ylbutanoic acid bromide Traditional Name: (2S)-2-amino-4-pyridazin-1-ium-1-yl-butyric acid bromide Formula: C8H12BrN3O2 MolecularWeight: 262.10378

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=[N+](N=C1)CCC(C(=O)O)N.[Br-]

Isomeric SMILES

C1=CC=[N+](N=C1)CC[C@@H](C(=O)O)N.[Br-]

InChI

InChI=1S/C8H11N3O2.BrH/c9-7(8(12)13)3-6-11-5-2-1-4-10-11;/h1-2,4-5,7H,3,6,9H2;1H/t7-;/m0./s1