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

Systemtic Name: 2-[4-[[2-butyl-5-(2-chlorophenyl)-4-methyl-6-oxidanylidene-pyrimidin-1-yl]methyl]-2-methyl-phenoxy]-2-phenyl-ethanoic acid Openeye Name: 2-[4-[[2-butyl-5-(2-chlorophenyl)-4-methyl-6-oxo-pyrimidin-1-yl]methyl]-2-methyl-phenoxy]-2-phenyl-acetic acid CAS Name: 2-[4-[[2-butyl-5-(2-chlorophenyl)-4-methyl-6-oxo-1-pyrimidinyl]methyl]-2-methylphenoxy]-2-phenylacetic acid IUPAC Name: 2-[4-[[2-butyl-5-(2-chlorophenyl)-4-methyl-6-oxopyrimidin-1-yl]methyl]-2-methylphenoxy]-2-phenylacetic acid Traditional Name: 2-[4-[[2-butyl-5-(2-chlorophenyl)-6-keto-4-methyl-pyrimidin-1-yl]methyl]-2-methyl-phenoxy]-2-phenyl-acetic acid Formula: C31H31ClN2O4 MolecularWeight: 531.04184

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC(=C(C(=O)N1CC2=CC(=C(C=C2)OC(C3=CC=CC=C3)C(=O)O)C)C4=CC=CC=C4Cl)C

Isomeric SMILES

CCCCC1=NC(=C(C(=O)N1CC2=CC(=C(C=C2)OC(C3=CC=CC=C3)C(=O)O)C)C4=CC=CC=C4Cl)C

InChI

InChI=1S/C31H31ClN2O4/c1-4-5-15-27-33-21(3)28(24-13-9-10-14-25(24)32)30(35)34(27)19-22-16-17-26(20(2)18-22)38-29(31(36)37)23-11-7-6-8-12-23/h6-14,16-18,29H,4-5,15,19H2,1-3H3,(H,36,37)