N-[2-(1,3-benzodioxol-5-yl)ethyl]-3-methyl-5-nitro-imidazol-4-amine

Systemtic Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-3-methyl-5-nitro-imidazol-4-amine Openeye Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-3-methyl-5-nitro-imidazol-4-amine CAS Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-3-methyl-5-nitro-4-imidazolamine IUPAC Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-3-methyl-5-nitroimidazol-4-amine Traditional Name: homopiperonyl-(3-methyl-5-nitro-imidazol-4-yl)amine Formula: C13H14N4O4 MolecularWeight: 290.27466

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC(=C1NCCC2=CC3=C(C=C2)OCO3)[N+](=O)[O-]

Isomeric SMILES

CN1C=NC(=C1NCCC2=CC3=C(C=C2)OCO3)[N+](=O)[O-]

InChI

InChI=1S/C13H14N4O4/c1-16-7-15-13(17(18)19)12(16)14-5-4-9-2-3-10-11(6-9)21-8-20-10/h2-3,6-7,14H,4-5,8H2,1H3