N'-[4-(2,2-diisocyanoethenyl)phenyl]-N'-methyl-ethyne-1,2-diamine

Systemtic Name: N'-[4-(2,2-diisocyanoethenyl)phenyl]-N'-methyl-ethyne-1,2-diamine Openeye Name: N'-[4-(2,2-diisocyanovinyl)phenyl]-N'-methyl-ethyne-1,2-diamine CAS Name: N'-[4-(2,2-diisocyanoethenyl)phenyl]-N'-methylethyne-1,2-diamine IUPAC Name: N'-[4-(2,2-diisocyanoethenyl)phenyl]-N'-methylethyne-1,2-diamine Traditional Name: 2-aminoethynyl-[4-(2,2-diisocyanovinyl)phenyl]-methyl-amine Formula: C13H10N4 MolecularWeight: 222.2453

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C#CN)C1=CC=C(C=C1)C=C([N+]#[C-])[N+]#[C-]

Isomeric SMILES

CN(C#CN)C1=CC=C(C=C1)C=C([N+]#[C-])[N+]#[C-]

InChI

InChI=1S/C13H10N4/c1-15-13(16-2)10-11-4-6-12(7-5-11)17(3)9-8-14/h4-7,10H,14H2,3H3