3-[5-(3-azanylpropyl)-1H-imidazol-4-yl]-2-oxidanyl-3-oxidanylidene-propanoic acid

Systemtic Name: 3-[5-(3-azanylpropyl)-1H-imidazol-4-yl]-2-oxidanyl-3-oxidanylidene-propanoic acid Openeye Name: 3-[5-(3-aminopropyl)-1H-imidazol-4-yl]-2-hydroxy-3-oxo-propanoic acid CAS Name: 3-[5-(3-aminopropyl)-1H-imidazol-4-yl]-2-hydroxy-3-oxopropanoic acid IUPAC Name: 3-[5-(3-aminopropyl)-1H-imidazol-4-yl]-2-hydroxy-3-oxopropanoic acid Traditional Name: 3-[5-(3-aminopropyl)-1H-imidazol-4-yl]-2-hydroxy-3-keto-propionic acid Formula: C9H13N3O4 MolecularWeight: 227.21722

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Descriptors Computed from Structure

Canonical SMILES:

C1=NC(=C(N1)CCCN)C(=O)C(C(=O)O)O

Isomeric SMILES

C1=NC(=C(N1)CCCN)C(=O)C(C(=O)O)O

InChI

InChI=1S/C9H13N3O4/c10-3-1-2-5-6(12-4-11-5)7(13)8(14)9(15)16/h4,8,14H,1-3,10H2,(H,11,12)(H,15,16)