2-[4-[(2-butyl-4-methyl-6-oxidanylidene-pyrimidin-1-yl)methyl]phenoxy]-2-(2-methylphenyl)ethanoic acid

Systemtic Name: 2-[4-[(2-butyl-4-methyl-6-oxidanylidene-pyrimidin-1-yl)methyl]phenoxy]-2-(2-methylphenyl)ethanoic acid Openeye Name: 2-[4-[(2-butyl-4-methyl-6-oxo-pyrimidin-1-yl)methyl]phenoxy]-2-(o-tolyl)acetic acid CAS Name: 2-[4-[(2-butyl-4-methyl-6-oxo-1-pyrimidinyl)methyl]phenoxy]-2-(2-methylphenyl)acetic acid IUPAC Name: 2-[4-[(2-butyl-4-methyl-6-oxopyrimidin-1-yl)methyl]phenoxy]-2-(2-methylphenyl)acetic acid Traditional Name: 2-[4-[(2-butyl-6-keto-4-methyl-pyrimidin-1-yl)methyl]phenoxy]-2-(o-tolyl)acetic acid Formula: C25H28N2O4 MolecularWeight: 420.50082

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC(=CC(=O)N1CC2=CC=C(C=C2)OC(C3=CC=CC=C3C)C(=O)O)C

Isomeric SMILES

CCCCC1=NC(=CC(=O)N1CC2=CC=C(C=C2)OC(C3=CC=CC=C3C)C(=O)O)C

InChI

InChI=1S/C25H28N2O4/c1-4-5-10-22-26-18(3)15-23(28)27(22)16-19-11-13-20(14-12-19)31-24(25(29)30)21-9-7-6-8-17(21)2/h6-9,11-15,24H,4-5,10,16H2,1-3H3,(H,29,30)