(2S)-5-(4-aminocarbonylpyridin-1-ium-1-yl)-2-azanyl-pentanoic acid bromide

Systemtic Name: (2S)-5-(4-aminocarbonylpyridin-1-ium-1-yl)-2-azanyl-pentanoic acid bromide Openeye Name: (2S)-2-amino-5-(4-carbamoylpyridin-1-ium-1-yl)pentanoic acid bromide CAS Name: (2S)-2-amino-5-(4-carbamoyl-1-pyridin-1-iumyl)pentanoic acid bromide IUPAC Name: (2S)-2-amino-5-(4-carbamoylpyridin-1-ium-1-yl)pentanoic acid bromide Traditional Name: (2S)-2-amino-5-(4-carbamoylpyridin-1-ium-1-yl)valeric acid bromide Formula: C11H16BrN3O3 MolecularWeight: 318.16704

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Descriptors Computed from Structure

Canonical SMILES:

C1=C[N+](=CC=C1C(=O)N)CCCC(C(=O)O)N.[Br-]

Isomeric SMILES

C1=C[N+](=CC=C1C(=O)N)CCC[C@@H](C(=O)O)N.[Br-]

InChI

InChI=1S/C11H15N3O3.BrH/c12-9(11(16)17)2-1-5-14-6-3-8(4-7-14)10(13)15;/h3-4,6-7,9H,1-2,5,12H2,(H2-,13,15,16,17);1H/t9-;/m0./s1