N-[2-(dimethylamino)ethanoyl]-4-[(3-methyl-2-nitro-imidazol-4-yl)methoxy]benzeneamine oxide

Systemtic Name: N-[2-(dimethylamino)ethanoyl]-4-[(3-methyl-2-nitro-imidazol-4-yl)methoxy]benzeneamine oxide Openeye Name: N-[2-(dimethylamino)acetyl]-4-[(3-methyl-2-nitro-imidazol-4-yl)methoxy]benzeneamine oxide CAS Name: N-[2-(dimethylamino)-1-oxoethyl]-4-[(3-methyl-2-nitro-4-imidazolyl)methoxy]benzeneamine oxide IUPAC Name: N-[2-(dimethylamino)acetyl]-4-[(3-methyl-2-nitroimidazol-4-yl)methoxy]benzeneamine oxide Traditional Name: N-[2-(dimethylamino)acetyl]-4-[(3-methyl-2-nitro-imidazol-4-yl)methoxy]benzeneamine oxide Formula: C15H19N5O5 MolecularWeight: 349.34186

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CN=C1[N+](=O)[O-])COC2=CC=C(C=C2)[NH+](C(=O)CN(C)C)[O-]

Isomeric SMILES

CN1C(=CN=C1[N+](=O)[O-])COC2=CC=C(C=C2)[NH+](C(=O)CN(C)C)[O-]

InChI

InChI=1S/C15H19N5O5/c1-17(2)9-14(21)19(22)11-4-6-13(7-5-11)25-10-12-8-16-15(18(12)3)20(23)24/h4-8,19H,9-10H2,1-3H3