(2-phenylpyrimidin-5-yl) 4-(4-fluorophenyl)-7-methyl-6-methylidene-3-oxidanyl-5-oxidanylidene-octanoate

Systemtic Name: (2-phenylpyrimidin-5-yl) 4-(4-fluorophenyl)-7-methyl-6-methylidene-3-oxidanyl-5-oxidanylidene-octanoate Openeye Name: (2-phenylpyrimidin-5-yl) 4-(4-fluorophenyl)-3-hydroxy-7-methyl-6-methylene-5-oxo-octanoate CAS Name: 4-(4-fluorophenyl)-3-hydroxy-7-methyl-6-methylene-5-oxooctanoic acid (2-phenyl-5-pyrimidinyl) ester IUPAC Name: (2-phenylpyrimidin-5-yl) 4-(4-fluorophenyl)-3-hydroxy-7-methyl-6-methylidene-5-oxooctanoate Traditional Name: 4-(4-fluorophenyl)-3-hydroxy-6-isopropyl-5-keto-hept-6-enoic acid (2-phenylpyrimidin-5-yl) ester Formula: C26H25FN2O4 MolecularWeight: 448.486103

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=C)C(=O)C(C1=CC=C(C=C1)F)C(CC(=O)OC2=CN=C(N=C2)C3=CC=CC=C3)O

Isomeric SMILES

CC(C)C(=C)C(=O)C(C1=CC=C(C=C1)F)C(CC(=O)OC2=CN=C(N=C2)C3=CC=CC=C3)O

InChI

InChI=1S/C26H25FN2O4/c1-16(2)17(3)25(32)24(18-9-11-20(27)12-10-18)22(30)13-23(31)33-21-14-28-26(29-15-21)19-7-5-4-6-8-19/h4-12,14-16,22,24,30H,3,13H2,1-2H3