(E)-but-2-enedioic acid; 4-(phenylsulfinyl)piperidine

Systemtic Name: (E)-but-2-enedioic acid; 4-(phenylsulfinyl)piperidine Openeye Name: 4-(benzenesulfinyl)piperidine; fumaric acid CAS Name: 4-(benzenesulfinyl)piperidine; (E)-2-butenedioic acid IUPAC Name: 4-(benzenesulfinyl)piperidine; (E)-but-2-enedioic acid Traditional Name: 4-(benzenesulfinyl)piperidine; fumaric acid Formula: C15H19NO5S MolecularWeight: 325.38006

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1S(=O)C2=CC=CC=C2.C(=CC(=O)O)C(=O)O

Isomeric SMILES

C1CNCCC1S(=O)C2=CC=CC=C2.C(=C/C(=O)O)\C(=O)O

InChI

InChI=1S/C11H15NOS.C4H4O4/c13-14(10-4-2-1-3-5-10)11-6-8-12-9-7-11;5-3(6)1-2-4(7)8/h1-5,11-12H,6-9H2;1-2H,(H,5,6)(H,7,8)/b;2-1+