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(E)-but-2-enedioate; pyridine-3,5-dicarboxylate

(E)-but-2-enedioate; pyridine-3,5-dicarboxylate

Systemtic Name:(E)-but-2-enedioate; pyridine-3,5-dicarboxylate
Openeye Name:(E)-but-2-enedioate; pyridine-3,5-dicarboxylate
CAS Name:(E)-2-butenedioate; pyridine-3,5-dicarboxylate
IUPAC Name:(E)-but-2-enedioate; pyridine-3,5-dicarboxylate
Traditional Name:dinicotinate fumarate
Formula: C11H5NO8-4
MolecularWeight: 279.1593
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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=NC=C1C(=O)[O-])C(=O)[O-].C(=CC(=O)[O-])C(=O)[O-]


Isomeric SMILES

C1=C(C=NC=C1C(=O)[O-])C(=O)[O-].C(=C/C(=O)[O-])\C(=O)[O-]


InChI

InChI=1S/C7H5NO4.C4H4O4/c9-6(10)4-1-5(7(11)12)3-8-2-4;5-3(6)1-2-4(7)8/h1-3H,(H,9,10)(H,11,12);1-2H,(H,5,6)(H,7,8)/p-4/b;2-1+


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