N-[3-(4-azanylbutylamino)propyl]-1-methyl-4-nitro-imidazole-2-carboxamide

Systemtic Name: N-[3-(4-azanylbutylamino)propyl]-1-methyl-4-nitro-imidazole-2-carboxamide Openeye Name: N-[3-(4-aminobutylamino)propyl]-1-methyl-4-nitro-imidazole-2-carboxamide CAS Name: N-[3-(4-aminobutylamino)propyl]-1-methyl-4-nitro-2-imidazolecarboxamide IUPAC Name: N-[3-(4-aminobutylamino)propyl]-1-methyl-4-nitroimidazole-2-carboxamide Traditional Name: N-[3-(4-aminobutylamino)propyl]-1-methyl-4-nitro-imidazole-2-carboxamide Formula: C12H22N6O3 MolecularWeight: 298.34148

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(N=C1C(=O)NCCCNCCCCN)[N+](=O)[O-]

Isomeric SMILES

CN1C=C(N=C1C(=O)NCCCNCCCCN)[N+](=O)[O-]

InChI

InChI=1S/C12H22N6O3/c1-17-9-10(18(20)21)16-11(17)12(19)15-8-4-7-14-6-3-2-5-13/h9,14H,2-8,13H2,1H3,(H,15,19)