(2S)-2-azanyl-3-(4-nitroimidazol-4-yl)propanoic acid

Systemtic Name: (2S)-2-azanyl-3-(4-nitroimidazol-4-yl)propanoic acid Openeye Name: (2S)-2-amino-3-(4-nitroimidazol-4-yl)propanoic acid CAS Name: (2S)-2-amino-3-(4-nitro-4-imidazolyl)propanoic acid IUPAC Name: (2S)-2-amino-3-(4-nitroimidazol-4-yl)propanoic acid Traditional Name: (2S)-2-amino-3-(4-nitroimidazol-4-yl)propionic acid Formula: C6H8N4O4 MolecularWeight: 200.15212

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Descriptors Computed from Structure

Canonical SMILES:

C1=NC=NC1(CC(C(=O)O)N)[N+](=O)[O-]

Isomeric SMILES

C1=NC=NC1(C[C@@H](C(=O)O)N)[N+](=O)[O-]

InChI

InChI=1S/C6H8N4O4/c7-4(5(11)12)1-6(10(13)14)2-8-3-9-6/h2-4H,1,7H2,(H,11,12)/t4-,6?/m0/s1