(E)-but-2-enedioic acid; 2-methylpiperazine-1-carboxylate

Systemtic Name: (E)-but-2-enedioic acid; 2-methylpiperazine-1-carboxylate Openeye Name: fumaric acid; 2-methylpiperazine-1-carboxylate CAS Name: (E)-2-butenedioic acid; 2-methyl-1-piperazinecarboxylate IUPAC Name: (E)-but-2-enedioic acid; 2-methylpiperazine-1-carboxylate Traditional Name: fumaric acid; 2-methylpiperazine-1-carboxylate Formula: C10H15N2O6- MolecularWeight: 259.2359

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Descriptors Computed from Structure

Canonical SMILES:

CC1CNCCN1C(=O)[O-].C(=CC(=O)O)C(=O)O

Isomeric SMILES

CC1CNCCN1C(=O)[O-].C(=C/C(=O)O)\C(=O)O

InChI

InChI=1S/C6H12N2O2.C4H4O4/c1-5-4-7-2-3-8(5)6(9)10;5-3(6)1-2-4(7)8/h5,7H,2-4H2,1H3,(H,9,10);1-2H,(H,5,6)(H,7,8)/p-1/b;2-1+