2-ethoxy-3-[4-[2-(4-methyl-6-oxidanylidene-2-propyl-pyrimidin-1-yl)ethoxy]phenyl]propanoic acid

Systemtic Name: 2-ethoxy-3-[4-[2-(4-methyl-6-oxidanylidene-2-propyl-pyrimidin-1-yl)ethoxy]phenyl]propanoic acid Openeye Name: 2-ethoxy-3-[4-[2-(4-methyl-6-oxo-2-propyl-pyrimidin-1-yl)ethoxy]phenyl]propanoic acid CAS Name: 2-ethoxy-3-[4-[2-(4-methyl-6-oxo-2-propyl-1-pyrimidinyl)ethoxy]phenyl]propanoic acid IUPAC Name: 2-ethoxy-3-[4-[2-(4-methyl-6-oxo-2-propylpyrimidin-1-yl)ethoxy]phenyl]propanoic acid Traditional Name: 2-ethoxy-3-[4-[2-(6-keto-4-methyl-2-propyl-pyrimidin-1-yl)ethoxy]phenyl]propionic acid Formula: C21H28N2O5 MolecularWeight: 388.45742

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC(=CC(=O)N1CCOC2=CC=C(C=C2)CC(C(=O)O)OCC)C

Isomeric SMILES

CCCC1=NC(=CC(=O)N1CCOC2=CC=C(C=C2)CC(C(=O)O)OCC)C

InChI

InChI=1S/C21H28N2O5/c1-4-6-19-22-15(3)13-20(24)23(19)11-12-28-17-9-7-16(8-10-17)14-18(21(25)26)27-5-2/h7-10,13,18H,4-6,11-12,14H2,1-3H3,(H,25,26)