(E)-but-2-enedioic acid; 3-chloranyl-5-piperidin-3-yloxy-pyridine

Systemtic Name: (E)-but-2-enedioic acid; 3-chloranyl-5-piperidin-3-yloxy-pyridine Openeye Name: 3-chloro-5-(3-piperidyloxy)pyridine; fumaric acid CAS Name: (E)-2-butenedioic acid; 3-chloro-5-(3-piperidinyloxy)pyridine IUPAC Name: (E)-but-2-enedioic acid; 3-chloro-5-piperidin-3-yloxypyridine Traditional Name: 3-chloro-5-(3-piperidyloxy)pyridine; fumaric acid Formula: C14H17ClN2O5 MolecularWeight: 328.74818

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CNC1)OC2=CC(=CN=C2)Cl.C(=CC(=O)O)C(=O)O

Isomeric SMILES

C1CC(CNC1)OC2=CC(=CN=C2)Cl.C(=C/C(=O)O)\C(=O)O

InChI

InChI=1S/C10H13ClN2O.C4H4O4/c11-8-4-10(7-13-5-8)14-9-2-1-3-12-6-9;5-3(6)1-2-4(7)8/h4-5,7,9,12H,1-3,6H2;1-2H,(H,5,6)(H,7,8)/b;2-1+