(E)-but-2-enedioic acid; 3-piperazin-1-ylpropan-1-ol

Systemtic Name: (E)-but-2-enedioic acid; 3-piperazin-1-ylpropan-1-ol Openeye Name: fumaric acid; 3-piperazin-1-ylpropan-1-ol CAS Name: (E)-2-butenedioic acid; 3-(1-piperazinyl)-1-propanol IUPAC Name: (E)-but-2-enedioic acid; 3-piperazin-1-ylpropan-1-ol Traditional Name: fumaric acid; 3-piperazinopropan-1-ol Formula: C11H20N2O5 MolecularWeight: 260.2869

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)CCCO.C(=CC(=O)O)C(=O)O

Isomeric SMILES

C1CN(CCN1)CCCO.C(=C/C(=O)O)\C(=O)O

InChI

InChI=1S/C7H16N2O.C4H4O4/c10-7-1-4-9-5-2-8-3-6-9;5-3(6)1-2-4(7)8/h8,10H,1-7H2;1-2H,(H,5,6)(H,7,8)/b;2-1+