N-(6-ethanoyl-1,3-benzodioxol-5-yl)-2-(4-nitroimidazol-1-yl)ethanamide

Systemtic Name: N-(6-ethanoyl-1,3-benzodioxol-5-yl)-2-(4-nitroimidazol-1-yl)ethanamide Openeye Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-2-(4-nitroimidazol-1-yl)acetamide CAS Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-2-(4-nitro-1-imidazolyl)acetamide IUPAC Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-2-(4-nitroimidazol-1-yl)acetamide Traditional Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-2-(4-nitroimidazol-1-yl)acetamide Formula: C14H12N4O6 MolecularWeight: 332.26828

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC2=C(C=C1NC(=O)CN3C=C(N=C3)[N+](=O)[O-])OCO2

Isomeric SMILES

CC(=O)C1=CC2=C(C=C1NC(=O)CN3C=C(N=C3)[N+](=O)[O-])OCO2

InChI

InChI=1S/C14H12N4O6/c1-8(19)9-2-11-12(24-7-23-11)3-10(9)16-14(20)5-17-4-13(15-6-17)18(21)22/h2-4,6H,5,7H2,1H3,(H,16,20)