(E)-N1'-[1-(6-chloranylpyridin-3-yl)butan-2-yl]-N1-methyl-2-nitro-ethene-1,1-diamine

Systemtic Name: (E)-N1'-[1-(6-chloranylpyridin-3-yl)butan-2-yl]-N1-methyl-2-nitro-ethene-1,1-diamine Openeye Name: (E)-N1'-[1-[(6-chloro-3-pyridyl)methyl]propyl]-N1-methyl-2-nitro-ethene-1,1-diamine CAS Name: (E)-N1'-[1-(6-chloro-3-pyridinyl)butan-2-yl]-N1-methyl-2-nitroethene-1,1-diamine IUPAC Name: (E)-1-N'-[1-(6-chloropyridin-3-yl)butan-2-yl]-1-N-methyl-2-nitroethene-1,1-diamine Traditional Name: 1-[(6-chloro-3-pyridyl)methyl]propyl-[(E)-1-(methylamino)-2-nitro-vinyl]amine Formula: C12H17ClN4O2 MolecularWeight: 284.74198

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC1=CN=C(C=C1)Cl)NC(=C[N+](=O)[O-])NC

Isomeric SMILES

CCC(CC1=CN=C(C=C1)Cl)N/C(=C/[N+](=O)[O-])/NC

InChI

InChI=1S/C12H17ClN4O2/c1-3-10(16-12(14-2)8-17(18)19)6-9-4-5-11(13)15-7-9/h4-5,7-8,10,14,16H,3,6H2,1-2H3/b12-8+