2-(dimethylamino)-4-(4-fluorophenyl)-7-methyl-6-methylidene-3,5-bis(oxidanyl)-2-pyrimidin-5-yl-octanoic acid

Systemtic Name: 2-(dimethylamino)-4-(4-fluorophenyl)-7-methyl-6-methylidene-3,5-bis(oxidanyl)-2-pyrimidin-5-yl-octanoic acid Openeye Name: 2-(dimethylamino)-4-(4-fluorophenyl)-3,5-dihydroxy-7-methyl-6-methylene-2-pyrimidin-5-yl-octanoic acid CAS Name: 2-(dimethylamino)-4-(4-fluorophenyl)-3,5-dihydroxy-7-methyl-6-methylene-2-(5-pyrimidinyl)octanoic acid IUPAC Name: 2-(dimethylamino)-4-(4-fluorophenyl)-3,5-dihydroxy-7-methyl-6-methylidene-2-pyrimidin-5-yloctanoic acid Traditional Name: 2-(dimethylamino)-4-(4-fluorophenyl)-3,5-dihydroxy-6-isopropyl-2-(5-pyrimidyl)hept-6-enoic acid Formula: C22H28FN3O4 MolecularWeight: 417.473823

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H28FN3O4/c1-13(2)14(3)19(27)18(15-6-8-17(23)9-7-15)20(28)22(21(29)30,26(4)5)16-10-24-12-25-11-16/h6-13,18-20,27-28H,3H2,1-2,4-5H3,(H,29,30)