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

Systemtic Name: 4-butan-2-yl-5-methoxy-2-(1-methyl-3,6-dihydro-2H-pyridin-5-yl)-1,3-oxazole; (E)-but-2-enedioic acid Openeye Name: fumaric acid; 5-methoxy-2-(1-methyl-3,6-dihydro-2H-pyridin-5-yl)-4-sec-butyl-oxazole CAS Name: 4-butan-2-yl-5-methoxy-2-(1-methyl-3,6-dihydro-2H-pyridin-5-yl)oxazole; (E)-2-butenedioic acid IUPAC Name: 4-butan-2-yl-5-methoxy-2-(1-methyl-3,6-dihydro-2H-pyridin-5-yl)-1,3-oxazole; (E)-but-2-enedioic acid Traditional Name: fumaric acid; 5-methoxy-2-(1-methyl-3,6-dihydro-2H-pyridin-5-yl)-4-sec-butyl-oxazole Formula: C18H26N2O6 MolecularWeight: 366.40884

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H22N2O2.C4H4O4/c1-5-10(2)12-14(17-4)18-13(15-12)11-7-6-8-16(3)9-11;5-3(6)1-2-4(7)8/h7,10H,5-6,8-9H2,1-4H3;1-2H,(H,5,6)(H,7,8)/b;2-1+