(E)-but-2-enedioic acid; N'-ethyl-N-[4-(2-ethyl-1H-imidazol-5-yl)phenyl]methanimidamide

Systemtic Name: (E)-but-2-enedioic acid; N'-ethyl-N-[4-(2-ethyl-1H-imidazol-5-yl)phenyl]methanimidamide Openeye Name: N'-ethyl-N-[4-(2-ethyl-1H-imidazol-5-yl)phenyl]formamidine; fumaric acid CAS Name: (E)-2-butenedioic acid; N'-ethyl-N-[4-(2-ethyl-1H-imidazol-5-yl)phenyl]methanimidamide IUPAC Name: (E)-but-2-enedioic acid; N'-ethyl-N-[4-(2-ethyl-1H-imidazol-5-yl)phenyl]methanimidamide Traditional Name: N'-ethyl-N-[4-(2-ethyl-1H-imidazol-5-yl)phenyl]formamidine; fumaric acid Formula: C18H22N4O4 MolecularWeight: 358.39168

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC=C(N1)C2=CC=C(C=C2)NC=NCC.C(=CC(=O)O)C(=O)O

Isomeric SMILES

CCC1=NC=C(N1)C2=CC=C(C=C2)NC=NCC.C(=C/C(=O)O)\C(=O)O

InChI

InChI=1S/C14H18N4.C4H4O4/c1-3-14-16-9-13(18-14)11-5-7-12(8-6-11)17-10-15-4-2;5-3(6)1-2-4(7)8/h5-10H,3-4H2,1-2H3,(H,15,17)(H,16,18);1-2H,(H,5,6)(H,7,8)/b;2-1+