1-(5-bicyclo[2.2.1]hept-2-enyl)ethanone; (E)-but-2-enedioic acid

Systemtic Name: 1-(5-bicyclo[2.2.1]hept-2-enyl)ethanone; (E)-but-2-enedioic acid Openeye Name: 1-(5-bicyclo[2.2.1]hept-2-enyl)ethanone; fumaric acid CAS Name: 1-(5-bicyclo[2.2.1]hept-2-enyl)ethanone; (E)-2-butenedioic acid IUPAC Name: 1-(5-bicyclo[2.2.1]hept-2-enyl)ethanone; (E)-but-2-enedioic acid Traditional Name: 1-(5-bicyclo[2.2.1]hept-2-enyl)ethanone; fumaric acid Formula: C13H16O5 MolecularWeight: 252.26314

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1CC2CC1C=C2.C(=CC(=O)O)C(=O)O

Isomeric SMILES

CC(=O)C1CC2CC1C=C2.C(=C/C(=O)O)\C(=O)O

InChI

InChI=1S/C9H12O.C4H4O4/c1-6(10)9-5-7-2-3-8(9)4-7;5-3(6)1-2-4(7)8/h2-3,7-9H,4-5H2,1H3;1-2H,(H,5,6)(H,7,8)/b;2-1+