(E)-but-2-enedioic acid; 3-piperidin-4-yl-2,3-dihydro-1H-inden-1-ol

Systemtic Name: (E)-but-2-enedioic acid; 3-piperidin-4-yl-2,3-dihydro-1H-inden-1-ol Openeye Name: fumaric acid; 3-(4-piperidyl)indan-1-ol CAS Name: (E)-2-butenedioic acid; 3-(4-piperidinyl)-2,3-dihydro-1H-inden-1-ol IUPAC Name: (E)-but-2-enedioic acid; 3-piperidin-4-yl-2,3-dihydro-1H-inden-1-ol Traditional Name: fumaric acid; 3-(4-piperidyl)indan-1-ol Formula: C18H23NO5 MolecularWeight: 333.37892

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1C2CC(C3=CC=CC=C23)O.C(=CC(=O)O)C(=O)O

Isomeric SMILES

C1CNCCC1C2CC(C3=CC=CC=C23)O.C(=C/C(=O)O)\C(=O)O

InChI

InChI=1S/C14H19NO.C4H4O4/c16-14-9-13(10-5-7-15-8-6-10)11-3-1-2-4-12(11)14;5-3(6)1-2-4(7)8/h1-4,10,13-16H,5-9H2;1-2H,(H,5,6)(H,7,8)/b;2-1+