(E)-but-2-enedioate; 1,2,3,6-tetrahydropyridine-5-carboxylate

Systemtic Name: (E)-but-2-enedioate; 1,2,3,6-tetrahydropyridine-5-carboxylate Openeye Name: (E)-but-2-enedioate; 1,2,3,6-tetrahydropyridine-5-carboxylate CAS Name: (E)-2-butenedioate; 1,2,3,6-tetrahydropyridine-5-carboxylate IUPAC Name: (E)-but-2-enedioate; 1,2,3,6-tetrahydropyridine-5-carboxylate Traditional Name: 1,2,3,6-tetrahydropyridine-5-carboxylate fumarate Formula: C10H10NO6-3 MolecularWeight: 240.1895

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCC(=C1)C(=O)[O-].C(=CC(=O)[O-])C(=O)[O-]

Isomeric SMILES

C1CNCC(=C1)C(=O)[O-].C(=C/C(=O)[O-])\C(=O)[O-]

InChI

InChI=1S/C6H9NO2.C4H4O4/c8-6(9)5-2-1-3-7-4-5;5-3(6)1-2-4(7)8/h2,7H,1,3-4H2,(H,8,9);1-2H,(H,5,6)(H,7,8)/p-3/b;2-1+