butanoyloxymethyl 1,2,3,6-tetrahydropyridine-4-carboxylate; (E)-but-2-enedioic acid

Systemtic Name: butanoyloxymethyl 1,2,3,6-tetrahydropyridine-4-carboxylate; (E)-but-2-enedioic acid Openeye Name: butanoyloxymethyl 1,2,3,6-tetrahydropyridine-4-carboxylate; fumaric acid CAS Name: (E)-2-butenedioic acid; 1,2,3,6-tetrahydropyridine-4-carboxylic acid 1-oxobutoxymethyl ester IUPAC Name: butanoyloxymethyl 1,2,3,6-tetrahydropyridine-4-carboxylate; (E)-but-2-enedioic acid Traditional Name: fumaric acid; 1,2,3,6-tetrahydropyridine-4-carboxylic acid butyryloxymethyl ester Formula: C15H21NO8 MolecularWeight: 343.32914

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)OCOC(=O)C1=CCNCC1.C(=CC(=O)O)C(=O)O

Isomeric SMILES

CCCC(=O)OCOC(=O)C1=CCNCC1.C(=C/C(=O)O)\C(=O)O

InChI

InChI=1S/C11H17NO4.C4H4O4/c1-2-3-10(13)15-8-16-11(14)9-4-6-12-7-5-9;5-3(6)1-2-4(7)8/h4,12H,2-3,5-8H2,1H3;1-2H,(H,5,6)(H,7,8)/b;2-1+