1-[2-azanyl-3-(1H-imidazol-5-yl)propanoyl]-1-(4-oxidanylideneazetidin-2-yl)carbonyl-pyrrolidin-1-ium-2-carboxylic acid

Systemtic Name: 1-[2-azanyl-3-(1H-imidazol-5-yl)propanoyl]-1-(4-oxidanylideneazetidin-2-yl)carbonyl-pyrrolidin-1-ium-2-carboxylic acid Openeye Name: 1-[2-amino-3-(1H-imidazol-5-yl)propanoyl]-1-(4-oxoazetidine-2-carbonyl)pyrrolidin-1-ium-2-carboxylic acid CAS Name: 1-[2-amino-3-(1H-imidazol-5-yl)-1-oxopropyl]-1-[oxo-(4-oxo-2-azetidinyl)methyl]-2-pyrrolidin-1-iumcarboxylic acid IUPAC Name: 1-[2-amino-3-(1H-imidazol-5-yl)propanoyl]-1-(4-oxoazetidine-2-carbonyl)pyrrolidin-1-ium-2-carboxylic acid Traditional Name: 1-[2-amino-3-(1H-imidazol-5-yl)propanoyl]-1-(4-ketoazetidine-2-carbonyl)pyrrolidin-1-ium-2-carboxylic acid Formula: C15H20N5O5+ MolecularWeight: 350.3498

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Descriptors Computed from Structure

Canonical SMILES:

C1CC([N+](C1)(C(=O)C2CC(=O)N2)C(=O)C(CC3=CN=CN3)N)C(=O)O

Isomeric SMILES

C1CC([N+](C1)(C(=O)C2CC(=O)N2)C(=O)C(CC3=CN=CN3)N)C(=O)O

InChI

InChI=1S/C15H19N5O5/c16-9(4-8-6-17-7-18-8)13(22)20(3-1-2-11(20)15(24)25)14(23)10-5-12(21)19-10/h6-7,9-11H,1-5,16H2,(H2-,17,18,19,21,24,25)/p+1