(E)-but-2-enedioic acid; N-[3-(1H-imidazol-5-yl)phenyl]-N'-methyl-methanimidamide

Systemtic Name: (E)-but-2-enedioic acid; N-[3-(1H-imidazol-5-yl)phenyl]-N'-methyl-methanimidamide Openeye Name: fumaric acid; N-[3-(1H-imidazol-5-yl)phenyl]-N'-methyl-formamidine CAS Name: (E)-2-butenedioic acid; N-[3-(1H-imidazol-5-yl)phenyl]-N'-methylmethanimidamide IUPAC Name: (E)-but-2-enedioic acid; N-[3-(1H-imidazol-5-yl)phenyl]-N'-methylmethanimidamide Traditional Name: fumaric acid; N-[3-(1H-imidazol-5-yl)phenyl]-N'-methyl-formamidine Formula: C15H16N4O4 MolecularWeight: 316.31194

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN=CNC1=CC=CC(=C1)C2=CN=CN2.C(=CC(=O)O)C(=O)O

Isomeric SMILES

CN=CNC1=CC=CC(=C1)C2=CN=CN2.C(=C/C(=O)O)\C(=O)O

InChI

InChI=1S/C11H12N4.C4H4O4/c1-12-7-14-10-4-2-3-9(5-10)11-6-13-8-15-11;5-3(6)1-2-4(7)8/h2-8H,1H3,(H,12,14)(H,13,15);1-2H,(H,5,6)(H,7,8)/b;2-1+