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

Systemtic Name: (E)-but-2-enedioic acid; 5-ethoxy-2-(1-methyl-3,6-dihydro-2H-pyridin-5-yl)-4-(2-methylpropyl)-1,3-oxazole Openeye Name: 5-ethoxy-4-isobutyl-2-(1-methyl-3,6-dihydro-2H-pyridin-5-yl)oxazole; fumaric acid CAS Name: (E)-2-butenedioic acid; 5-ethoxy-2-(1-methyl-3,6-dihydro-2H-pyridin-5-yl)-4-(2-methylpropyl)oxazole IUPAC Name: (E)-but-2-enedioic acid; 5-ethoxy-2-(1-methyl-3,6-dihydro-2H-pyridin-5-yl)-4-(2-methylpropyl)-1,3-oxazole Traditional Name: 5-ethoxy-4-isobutyl-2-(1-methyl-3,6-dihydro-2H-pyridin-5-yl)oxazole; fumaric acid Formula: C19H28N2O6 MolecularWeight: 380.43542

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(N=C(O1)C2=CCCN(C2)C)CC(C)C.C(=CC(=O)O)C(=O)O

Isomeric SMILES

CCOC1=C(N=C(O1)C2=CCCN(C2)C)CC(C)C.C(=C/C(=O)O)\C(=O)O

InChI

InChI=1S/C15H24N2O2.C4H4O4/c1-5-18-15-13(9-11(2)3)16-14(19-15)12-7-6-8-17(4)10-12;5-3(6)1-2-4(7)8/h7,11H,5-6,8-10H2,1-4H3;1-2H,(H,5,6)(H,7,8)/b;2-1+