(E)-but-2-enedioate; 2-piperazin-1-ylethanoate

Systemtic Name: (E)-but-2-enedioate; 2-piperazin-1-ylethanoate Openeye Name: (E)-but-2-enedioate; 2-piperazin-1-ylacetate CAS Name: (E)-2-butenedioate; 2-(1-piperazinyl)acetate IUPAC Name: (E)-but-2-enedioate; 2-piperazin-1-ylacetate Traditional Name: 2-piperazinoacetate fumarate Formula: C10H13N2O6-3 MolecularWeight: 257.22002

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)CC(=O)[O-].C(=CC(=O)[O-])C(=O)[O-]

Isomeric SMILES

C1CN(CCN1)CC(=O)[O-].C(=C/C(=O)[O-])\C(=O)[O-]

InChI

InChI=1S/C6H12N2O2.C4H4O4/c9-6(10)5-8-3-1-7-2-4-8;5-3(6)1-2-4(7)8/h7H,1-5H2,(H,9,10);1-2H,(H,5,6)(H,7,8)/p-3/b;2-1+