2-acetamido-3-(4-nitroimidazol-4-yl)propanoic acid

Systemtic Name: 2-acetamido-3-(4-nitroimidazol-4-yl)propanoic acid Openeye Name: 2-acetamido-3-(4-nitroimidazol-4-yl)propanoic acid CAS Name: 2-acetamido-3-(4-nitro-4-imidazolyl)propanoic acid IUPAC Name: 2-acetamido-3-(4-nitroimidazol-4-yl)propanoic acid Traditional Name: 2-acetamido-3-(4-nitroimidazol-4-yl)propionic acid Formula: C8H10N4O5 MolecularWeight: 242.1888

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CC1(C=NC=N1)[N+](=O)[O-])C(=O)O

Isomeric SMILES

CC(=O)NC(CC1(C=NC=N1)[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C8H10N4O5/c1-5(13)11-6(7(14)15)2-8(12(16)17)3-9-4-10-8/h3-4,6H,2H2,1H3,(H,11,13)(H,14,15)