N-(2-hydroxyethyl)-3-(4-nitroimidazol-1-yl)propanamide

Systemtic Name: N-(2-hydroxyethyl)-3-(4-nitroimidazol-1-yl)propanamide Openeye Name: N-(2-hydroxyethyl)-3-(4-nitroimidazol-1-yl)propanamide CAS Name: N-(2-hydroxyethyl)-3-(4-nitro-1-imidazolyl)propanamide IUPAC Name: N-(2-hydroxyethyl)-3-(4-nitroimidazol-1-yl)propanamide Traditional Name: N-(2-hydroxyethyl)-3-(4-nitroimidazol-1-yl)propionamide Formula: C8H12N4O4 MolecularWeight: 228.20528

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(N=CN1CCC(=O)NCCO)[N+](=O)[O-]

Isomeric SMILES

C1=C(N=CN1CCC(=O)NCCO)[N+](=O)[O-]

InChI

InChI=1S/C8H12N4O4/c13-4-2-9-8(14)1-3-11-5-7(10-6-11)12(15)16/h5-6,13H,1-4H2,(H,9,14)