(E)-but-2-enedioic acid; 2-(1,2-diethylpyrazolidin-4-yl)isoindole-1,3-dione

Systemtic Name: (E)-but-2-enedioic acid; 2-(1,2-diethylpyrazolidin-4-yl)isoindole-1,3-dione Openeye Name: 2-(1,2-diethylpyrazolidin-4-yl)isoindoline-1,3-dione; fumaric acid CAS Name: (E)-2-butenedioic acid; 2-(1,2-diethyl-4-pyrazolidinyl)isoindole-1,3-dione IUPAC Name: (E)-but-2-enedioic acid; 2-(1,2-diethylpyrazolidin-4-yl)isoindole-1,3-dione Traditional Name: 2-(1,2-diethylpyrazolidin-4-yl)isoindoline-1,3-quinone; fumaric acid Formula: C19H23N3O6 MolecularWeight: 389.40242

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CC(CN1CC)N2C(=O)C3=CC=CC=C3C2=O.C(=CC(=O)O)C(=O)O

Isomeric SMILES

CCN1CC(CN1CC)N2C(=O)C3=CC=CC=C3C2=O.C(=C/C(=O)O)\C(=O)O

InChI

InChI=1S/C15H19N3O2.C4H4O4/c1-3-16-9-11(10-17(16)4-2)18-14(19)12-7-5-6-8-13(12)15(18)20;5-3(6)1-2-4(7)8/h5-8,11H,3-4,9-10H2,1-2H3;1-2H,(H,5,6)(H,7,8)/b;2-1+