2-[4-[(2-butyl-4-methyl-6-oxidanylidene-5-phenyl-pyrimidin-1-yl)methyl]-2-propyl-phenoxy]-2-(2-chlorophenyl)ethanoic acid

Systemtic Name: 2-[4-[(2-butyl-4-methyl-6-oxidanylidene-5-phenyl-pyrimidin-1-yl)methyl]-2-propyl-phenoxy]-2-(2-chlorophenyl)ethanoic acid Openeye Name: 2-[4-[(2-butyl-4-methyl-6-oxo-5-phenyl-pyrimidin-1-yl)methyl]-2-propyl-phenoxy]-2-(2-chlorophenyl)acetic acid CAS Name: 2-[4-[(2-butyl-4-methyl-6-oxo-5-phenyl-1-pyrimidinyl)methyl]-2-propylphenoxy]-2-(2-chlorophenyl)acetic acid IUPAC Name: 2-[4-[(2-butyl-4-methyl-6-oxo-5-phenylpyrimidin-1-yl)methyl]-2-propylphenoxy]-2-(2-chlorophenyl)acetic acid Traditional Name: 2-[4-[(2-butyl-6-keto-4-methyl-5-phenyl-pyrimidin-1-yl)methyl]-2-propyl-phenoxy]-2-(2-chlorophenyl)acetic acid Formula: C33H35ClN2O4 MolecularWeight: 559.095

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC(=C(C(=O)N1CC2=CC(=C(C=C2)OC(C3=CC=CC=C3Cl)C(=O)O)CCC)C4=CC=CC=C4)C

Isomeric SMILES

CCCCC1=NC(=C(C(=O)N1CC2=CC(=C(C=C2)OC(C3=CC=CC=C3Cl)C(=O)O)CCC)C4=CC=CC=C4)C

InChI

InChI=1S/C33H35ClN2O4/c1-4-6-17-29-35-22(3)30(24-13-8-7-9-14-24)32(37)36(29)21-23-18-19-28(25(20-23)12-5-2)40-31(33(38)39)26-15-10-11-16-27(26)34/h7-11,13-16,18-20,31H,4-6,12,17,21H2,1-3H3,(H,38,39)