(E)-2-(1H-benzimidazol-2-yl)-4-(dimethylamino)but-2-enenitrile; perchloric acid

Systemtic Name: (E)-2-(1H-benzimidazol-2-yl)-4-(dimethylamino)but-2-enenitrile; perchloric acid Openeye Name: (E)-2-(1H-benzimidazol-2-yl)-4-(dimethylamino)but-2-enenitrile; perchloric acid CAS Name: (E)-2-(1H-benzimidazol-2-yl)-4-(dimethylamino)-2-butenenitrile; perchloric acid IUPAC Name: (E)-2-(1H-benzimidazol-2-yl)-4-(dimethylamino)but-2-enenitrile; perchloric acid Traditional Name: (E)-2-(1H-benzimidazol-2-yl)-4-(dimethylamino)but-2-enenitrile; perchloric acid Formula: C13H15ClN4O4 MolecularWeight: 326.7356

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC=C(C#N)C1=NC2=CC=CC=C2N1.OCl(=O)(=O)=O

Isomeric SMILES

CN(C)C/C=C(\C#N)/C1=NC2=CC=CC=C2N1.OCl(=O)(=O)=O

InChI

InChI=1S/C13H14N4.ClHO4/c1-17(2)8-7-10(9-14)13-15-11-5-3-4-6-12(11)16-13;2-1(3,4)5/h3-7H,8H2,1-2H3,(H,15,16);(H,2,3,4,5)/b10-7+;