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(E)-but-2-enedioic acid; phthalate

(E)-but-2-enedioic acid; phthalate

Systemtic Name:(E)-but-2-enedioic acid; phthalate
Openeye Name:fumaric acid; phthalate
CAS Name:(E)-2-butenedioic acid; phthalate
IUPAC Name:(E)-but-2-enedioic acid; phthalate
Traditional Name:fumaric acid; phthalate
Formula: C12H8O8-2
MolecularWeight: 280.18712
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)[O-])C(=O)[O-].C(=CC(=O)O)C(=O)O


Isomeric SMILES

C1=CC=C(C(=C1)C(=O)[O-])C(=O)[O-].C(=C/C(=O)O)\C(=O)O


InChI

InChI=1S/C8H6O4.C4H4O4/c9-7(10)5-3-1-2-4-6(5)8(11)12;5-3(6)1-2-4(7)8/h1-4H,(H,9,10)(H,11,12);1-2H,(H,5,6)(H,7,8)/p-2/b;2-1+


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