benzene; buta-1,3-diene; (E)-but-2-enedioic acid

Systemtic Name: benzene; buta-1,3-diene; (E)-but-2-enedioic acid Openeye Name: benzene; buta-1,3-diene; fumaric acid CAS Name: benzene; buta-1,3-diene; (E)-2-butenedioic acid IUPAC Name: benzene; buta-1,3-diene; (E)-but-2-enedioic acid Traditional Name: benzene; buta-1,3-diene; fumaric acid Formula: C14H16O4 MolecularWeight: 248.27444

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Descriptors Computed from Structure

Canonical SMILES:

C=CC=C.C1=CC=CC=C1.C(=CC(=O)O)C(=O)O

Isomeric SMILES

C=CC=C.C1=CC=CC=C1.C(=C/C(=O)O)\C(=O)O

InChI

InChI=1S/C6H6.C4H4O4.C4H6/c1-2-4-6-5-3-1;5-3(6)1-2-4(7)8;1-3-4-2/h1-6H;1-2H,(H,5,6)(H,7,8);3-4H,1-2H2/b;2-1+;