N-(1,3-benzodioxol-5-yl)-3,5-dinitro-pyridin-2-amine

Systemtic Name: N-(1,3-benzodioxol-5-yl)-3,5-dinitro-pyridin-2-amine Openeye Name: N-(1,3-benzodioxol-5-yl)-3,5-dinitro-pyridin-2-amine CAS Name: N-(1,3-benzodioxol-5-yl)-3,5-dinitro-2-pyridinamine IUPAC Name: N-(1,3-benzodioxol-5-yl)-3,5-dinitropyridin-2-amine Traditional Name: 1,3-benzodioxol-5-yl-(3,5-dinitro-2-pyridyl)amine Formula: C12H8N4O6 MolecularWeight: 304.21512

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)NC3=C(C=C(C=N3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)NC3=C(C=C(C=N3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C12H8N4O6/c17-15(18)8-4-9(16(19)20)12(13-5-8)14-7-1-2-10-11(3-7)22-6-21-10/h1-5H,6H2,(H,13,14)