(E)-N1'-cyclohexyl-N1-[4-(5-methylimidazol-1-yl)butyl]-2-nitro-ethene-1,1-diamine

Systemtic Name: (E)-N1'-cyclohexyl-N1-[4-(5-methylimidazol-1-yl)butyl]-2-nitro-ethene-1,1-diamine Openeye Name: (E)-N1'-cyclohexyl-N1-[4-(5-methylimidazol-1-yl)butyl]-2-nitro-ethene-1,1-diamine CAS Name: (E)-N1'-cyclohexyl-N1-[4-(5-methyl-1-imidazolyl)butyl]-2-nitroethene-1,1-diamine IUPAC Name: (E)-1-N'-cyclohexyl-1-N-[4-(5-methylimidazol-1-yl)butyl]-2-nitroethene-1,1-diamine Traditional Name: cyclohexyl-[(E)-1-[4-(5-methylimidazol-1-yl)butylamino]-2-nitro-vinyl]amine Formula: C16H27N5O2 MolecularWeight: 321.41788

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=CN1CCCCNC(=C[N+](=O)[O-])NC2CCCCC2

Isomeric SMILES

CC1=CN=CN1CCCCN/C(=C\[N+](=O)[O-])/NC2CCCCC2

InChI

InChI=1S/C16H27N5O2/c1-14-11-17-13-20(14)10-6-5-9-18-16(12-21(22)23)19-15-7-3-2-4-8-15/h11-13,15,18-19H,2-10H2,1H3/b16-12+