5-(1-benzofuran-2-ylmethyl)-4,5-dihydro-1H-imidazole; (E)-but-2-enedioic acid

Systemtic Name: 5-(1-benzofuran-2-ylmethyl)-4,5-dihydro-1H-imidazole; (E)-but-2-enedioic acid Openeye Name: 5-(benzofuran-2-ylmethyl)-4,5-dihydro-1H-imidazole; fumaric acid CAS Name: 5-(2-benzofuranylmethyl)-4,5-dihydro-1H-imidazole; (E)-2-butenedioic acid IUPAC Name: 5-(1-benzofuran-2-ylmethyl)-4,5-dihydro-1H-imidazole; (E)-but-2-enedioic acid Traditional Name: 4-(benzofuran-2-ylmethyl)-2-imidazoline; fumaric acid Formula: C16H16N2O5 MolecularWeight: 316.30864

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Descriptors Computed from Structure

Canonical SMILES:

C1C(NC=N1)CC2=CC3=CC=CC=C3O2.C(=CC(=O)O)C(=O)O

Isomeric SMILES

C1C(NC=N1)CC2=CC3=CC=CC=C3O2.C(=C/C(=O)O)\C(=O)O

InChI

InChI=1S/C12H12N2O.C4H4O4/c1-2-4-12-9(3-1)5-11(15-12)6-10-7-13-8-14-10;5-3(6)1-2-4(7)8/h1-5,8,10H,6-7H2,(H,13,14);1-2H,(H,5,6)(H,7,8)/b;2-1+