(E)-but-2-enedioate; 2-ethylpiperazine-1-carboxylate

Systemtic Name: (E)-but-2-enedioate; 2-ethylpiperazine-1-carboxylate Openeye Name: (E)-but-2-enedioate; 2-ethylpiperazine-1-carboxylate CAS Name: (E)-2-butenedioate; 2-ethyl-1-piperazinecarboxylate IUPAC Name: (E)-but-2-enedioate; 2-ethylpiperazine-1-carboxylate Traditional Name: 2-ethylpiperazine-1-carboxylate fumarate Formula: C11H15N2O6-3 MolecularWeight: 271.2466

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CNCCN1C(=O)[O-].C(=CC(=O)[O-])C(=O)[O-]

Isomeric SMILES

CCC1CNCCN1C(=O)[O-].C(=C/C(=O)[O-])\C(=O)[O-]

InChI

InChI=1S/C7H14N2O2.C4H4O4/c1-2-6-5-8-3-4-9(6)7(10)11;5-3(6)1-2-4(7)8/h6,8H,2-5H2,1H3,(H,10,11);1-2H,(H,5,6)(H,7,8)/p-3/b;2-1+