2-(2-azanylethoxy)-1-(1-benzofuran-5-yl)ethanol; (E)-but-2-enedioic acid

Systemtic Name: 2-(2-azanylethoxy)-1-(1-benzofuran-5-yl)ethanol; (E)-but-2-enedioic acid Openeye Name: 2-(2-aminoethoxy)-1-(benzofuran-5-yl)ethanol; fumaric acid CAS Name: 2-(2-aminoethoxy)-1-(5-benzofuranyl)ethanol; (E)-2-butenedioic acid IUPAC Name: 2-(2-aminoethoxy)-1-(1-benzofuran-5-yl)ethanol; (E)-but-2-enedioic acid Traditional Name: 2-(2-aminoethoxy)-1-(benzofuran-5-yl)ethanol; fumaric acid Formula: C28H34N2O10 MolecularWeight: 558.57696

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CO2)C=C1C(COCCN)O.C1=CC2=C(C=CO2)C=C1C(COCCN)O.C(=CC(=O)O)C(=O)O

Isomeric SMILES

C1=CC2=C(C=CO2)C=C1C(COCCN)O.C1=CC2=C(C=CO2)C=C1C(COCCN)O.C(=C/C(=O)O)\C(=O)O

InChI

InChI=1S/2C12H15NO3.C4H4O4/c2*13-4-6-15-8-11(14)9-1-2-12-10(7-9)3-5-16-12;5-3(6)1-2-4(7)8/h2*1-3,5,7,11,14H,4,6,8,13H2;1-2H,(H,5,6)(H,7,8)/b;;2-1+