1-(1-benzofuran-2-yl)-3-(5-methyl-1H-imidazol-4-yl)propan-1-one; (E)-but-2-enedioic acid

Systemtic Name: 1-(1-benzofuran-2-yl)-3-(5-methyl-1H-imidazol-4-yl)propan-1-one; (E)-but-2-enedioic acid Openeye Name: 1-(benzofuran-2-yl)-3-(5-methyl-1H-imidazol-4-yl)propan-1-one; fumaric acid CAS Name: 1-(2-benzofuranyl)-3-(5-methyl-1H-imidazol-4-yl)-1-propanone; (E)-2-butenedioic acid IUPAC Name: 1-(1-benzofuran-2-yl)-3-(5-methyl-1H-imidazol-4-yl)propan-1-one; (E)-but-2-enedioic acid Traditional Name: 1-(benzofuran-2-yl)-3-(5-methyl-1H-imidazol-4-yl)propan-1-one; fumaric acid Formula: C19H18N2O6 MolecularWeight: 370.35602

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=CN1)CCC(=O)C2=CC3=CC=CC=C3O2.C(=CC(=O)O)C(=O)O

Isomeric SMILES

CC1=C(N=CN1)CCC(=O)C2=CC3=CC=CC=C3O2.C(=C/C(=O)O)\C(=O)O

InChI

InChI=1S/C15H14N2O2.C4H4O4/c1-10-12(17-9-16-10)6-7-13(18)15-8-11-4-2-3-5-14(11)19-15;5-3(6)1-2-4(7)8/h2-5,8-9H,6-7H2,1H3,(H,16,17);1-2H,(H,5,6)(H,7,8)/b;2-1+