N-(1,3-benzodioxol-5-ylmethyl)-N-ethyl-3-methyl-5-nitro-imidazol-4-amine

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-N-ethyl-3-methyl-5-nitro-imidazol-4-amine Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-N-ethyl-3-methyl-5-nitro-imidazol-4-amine CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-N-ethyl-3-methyl-5-nitro-4-imidazolamine IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-N-ethyl-3-methyl-5-nitroimidazol-4-amine Traditional Name: ethyl-(3-methyl-5-nitro-imidazol-4-yl)-piperonyl-amine Formula: C14H16N4O4 MolecularWeight: 304.30124

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC2=C(C=C1)OCO2)C3=C(N=CN3C)[N+](=O)[O-]

Isomeric SMILES

CCN(CC1=CC2=C(C=C1)OCO2)C3=C(N=CN3C)[N+](=O)[O-]

InChI

InChI=1S/C14H16N4O4/c1-3-17(14-13(18(19)20)15-8-16(14)2)7-10-4-5-11-12(6-10)22-9-21-11/h4-6,8H,3,7,9H2,1-2H3