1-methyl-N-[3-[4-[(1-methyl-4-nitro-imidazol-2-yl)amino]butylamino]propyl]-4-nitro-imidazole-2-carboxamide

Systemtic Name: 1-methyl-N-[3-[4-[(1-methyl-4-nitro-imidazol-2-yl)amino]butylamino]propyl]-4-nitro-imidazole-2-carboxamide Openeye Name: 1-methyl-N-[3-[4-[(1-methyl-4-nitro-imidazol-2-yl)amino]butylamino]propyl]-4-nitro-imidazole-2-carboxamide CAS Name: 1-methyl-N-[3-[4-[(1-methyl-4-nitro-2-imidazolyl)amino]butylamino]propyl]-4-nitro-2-imidazolecarboxamide IUPAC Name: 1-methyl-N-[3-[4-[(1-methyl-4-nitroimidazol-2-yl)amino]butylamino]propyl]-4-nitroimidazole-2-carboxamide Traditional Name: 1-methyl-N-[3-[4-[(1-methyl-4-nitro-imidazol-2-yl)amino]butylamino]propyl]-4-nitro-imidazole-2-carboxamide Formula: C16H25N9O5 MolecularWeight: 423.427

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(N=C1C(=O)NCCCNCCCCNC2=NC(=CN2C)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CN1C=C(N=C1C(=O)NCCCNCCCCNC2=NC(=CN2C)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C16H25N9O5/c1-22-10-12(24(27)28)20-14(22)15(26)18-9-5-7-17-6-3-4-8-19-16-21-13(25(29)30)11-23(16)2/h10-11,17H,3-9H2,1-2H3,(H,18,26)(H,19,21)