(E)-but-2-enedioic acid; 5-methoxy-2-(1-methyl-3,6-dihydro-2H-pyridin-5-yl)-4-propan-2-yl-1,3-oxazole

Systemtic Name: (E)-but-2-enedioic acid; 5-methoxy-2-(1-methyl-3,6-dihydro-2H-pyridin-5-yl)-4-propan-2-yl-1,3-oxazole Openeye Name: fumaric acid; 4-isopropyl-5-methoxy-2-(1-methyl-3,6-dihydro-2H-pyridin-5-yl)oxazole CAS Name: (E)-2-butenedioic acid; 5-methoxy-2-(1-methyl-3,6-dihydro-2H-pyridin-5-yl)-4-propan-2-yloxazole IUPAC Name: (E)-but-2-enedioic acid; 5-methoxy-2-(1-methyl-3,6-dihydro-2H-pyridin-5-yl)-4-propan-2-yl-1,3-oxazole Traditional Name: fumaric acid; 4-isopropyl-5-methoxy-2-(1-methyl-3,6-dihydro-2H-pyridin-5-yl)oxazole Formula: C17H24N2O6 MolecularWeight: 352.38226

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(OC(=N1)C2=CCCN(C2)C)OC.C(=CC(=O)O)C(=O)O

Isomeric SMILES

CC(C)C1=C(OC(=N1)C2=CCCN(C2)C)OC.C(=C/C(=O)O)\C(=O)O

InChI

InChI=1S/C13H20N2O2.C4H4O4/c1-9(2)11-13(16-4)17-12(14-11)10-6-5-7-15(3)8-10;5-3(6)1-2-4(7)8/h6,9H,5,7-8H2,1-4H3;1-2H,(H,5,6)(H,7,8)/b;2-1+