N2-[(E)-1-(5-nitrofuran-2-yl)butylideneamino]-1,3,5-triazine-2,4,6-triamine

Systemtic Name: N2-[(E)-1-(5-nitrofuran-2-yl)butylideneamino]-1,3,5-triazine-2,4,6-triamine Openeye Name: N2-[(E)-1-(5-nitro-2-furyl)butylideneamino]-1,3,5-triazine-2,4,6-triamine CAS Name: N2-[(E)-1-(5-nitro-2-furanyl)butylideneamino]-1,3,5-triazine-2,4,6-triamine IUPAC Name: 2-N-[(E)-1-(5-nitrofuran-2-yl)butylideneamino]-1,3,5-triazine-2,4,6-triamine Traditional Name: (4,6-diamino-s-triazin-2-yl)-[(E)-1-(5-nitro-2-furyl)butylideneamino]amine Formula: C11H14N8O3 MolecularWeight: 306.28066

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=NNC1=NC(=NC(=N1)N)N)C2=CC=C(O2)[N+](=O)[O-]

Isomeric SMILES

CCC/C(=N\NC1=NC(=NC(=N1)N)N)/C2=CC=C(O2)[N+](=O)[O-]

InChI

InChI=1S/C11H14N8O3/c1-2-3-6(7-4-5-8(22-7)19(20)21)17-18-11-15-9(12)14-10(13)16-11/h4-5H,2-3H2,1H3,(H5,12,13,14,15,16,18)/b17-6+