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benzoic acid; (E)-but-2-enedioate

benzoic acid; (E)-but-2-enedioate

Systemtic Name:benzoic acid; (E)-but-2-enedioate
Openeye Name:benzoic acid; (E)-but-2-enedioate
CAS Name:benzoic acid; (E)-2-butenedioate
IUPAC Name:benzoic acid; (E)-but-2-enedioate
Traditional Name:benzoic acid fumarate
Formula: C11H8O6-2
MolecularWeight: 236.17762
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C7H6O2.C4H4O4/c8-7(9)6-4-2-1-3-5-6;5-3(6)1-2-4(7)8/h1-5H,(H,8,9);1-2H,(H,5,6)(H,7,8)/p-2/b;2-1+


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