2-[4-[2-(2-ethyl-6-oxidanylidene-4-phenyl-pyrimidin-1-yl)ethoxy]phenoxy]-3-methyl-butanoic acid

Systemtic Name: 2-[4-[2-(2-ethyl-6-oxidanylidene-4-phenyl-pyrimidin-1-yl)ethoxy]phenoxy]-3-methyl-butanoic acid Openeye Name: 2-[4-[2-(2-ethyl-6-oxo-4-phenyl-pyrimidin-1-yl)ethoxy]phenoxy]-3-methyl-butanoic acid CAS Name: 2-[4-[2-(2-ethyl-6-oxo-4-phenyl-1-pyrimidinyl)ethoxy]phenoxy]-3-methylbutanoic acid IUPAC Name: 2-[4-[2-(2-ethyl-6-oxo-4-phenylpyrimidin-1-yl)ethoxy]phenoxy]-3-methylbutanoic acid Traditional Name: 2-[4-[2-(2-ethyl-6-keto-4-phenyl-pyrimidin-1-yl)ethoxy]phenoxy]-3-methyl-butyric acid Formula: C25H28N2O5 MolecularWeight: 436.50022

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC(=CC(=O)N1CCOC2=CC=C(C=C2)OC(C(C)C)C(=O)O)C3=CC=CC=C3

Isomeric SMILES

CCC1=NC(=CC(=O)N1CCOC2=CC=C(C=C2)OC(C(C)C)C(=O)O)C3=CC=CC=C3

InChI

InChI=1S/C25H28N2O5/c1-4-22-26-21(18-8-6-5-7-9-18)16-23(28)27(22)14-15-31-19-10-12-20(13-11-19)32-24(17(2)3)25(29)30/h5-13,16-17,24H,4,14-15H2,1-3H3,(H,29,30)