N-(1,3-benzodioxol-5-ylmethyl)-6-imidazol-1-yl-5-nitro-pyrimidin-4-amine

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-6-imidazol-1-yl-5-nitro-pyrimidin-4-amine Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-6-imidazol-1-yl-5-nitro-pyrimidin-4-amine CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-6-(1-imidazolyl)-5-nitro-4-pyrimidinamine IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-6-imidazol-1-yl-5-nitropyrimidin-4-amine Traditional Name: (6-imidazol-1-yl-5-nitro-pyrimidin-4-yl)-piperonyl-amine Formula: C15H12N6O4 MolecularWeight: 340.29358

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC3=NC=NC(=C3[N+](=O)[O-])N4C=CN=C4

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC3=NC=NC(=C3[N+](=O)[O-])N4C=CN=C4

InChI

InChI=1S/C15H12N6O4/c22-21(23)13-14(18-7-19-15(13)20-4-3-16-8-20)17-6-10-1-2-11-12(5-10)25-9-24-11/h1-5,7-8H,6,9H2,(H,17,18,19)