2-[4-(4-fluorophenyl)-2-phenyl-6-propan-2-yl-pyrimidin-5-yl]-3,5-bis(oxidanyl)hept-6-enoic acid

Systemtic Name: 2-[4-(4-fluorophenyl)-2-phenyl-6-propan-2-yl-pyrimidin-5-yl]-3,5-bis(oxidanyl)hept-6-enoic acid Openeye Name: 2-[4-(4-fluorophenyl)-6-isopropyl-2-phenyl-pyrimidin-5-yl]-3,5-dihydroxy-hept-6-enoic acid CAS Name: 2-[4-(4-fluorophenyl)-2-phenyl-6-propan-2-yl-5-pyrimidinyl]-3,5-dihydroxy-6-heptenoic acid IUPAC Name: 2-[4-(4-fluorophenyl)-2-phenyl-6-propan-2-ylpyrimidin-5-yl]-3,5-dihydroxyhept-6-enoic acid Traditional Name: 2-[4-(4-fluorophenyl)-6-isopropyl-2-phenyl-pyrimidin-5-yl]-3,5-dihydroxy-hept-6-enoic acid Formula: C26H27FN2O4 MolecularWeight: 450.501983

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NC(=NC(=C1C(C(CC(C=C)O)O)C(=O)O)C2=CC=C(C=C2)F)C3=CC=CC=C3

Isomeric SMILES

CC(C)C1=NC(=NC(=C1C(C(CC(C=C)O)O)C(=O)O)C2=CC=C(C=C2)F)C3=CC=CC=C3

InChI

InChI=1S/C26H27FN2O4/c1-4-19(30)14-20(31)21(26(32)33)22-23(15(2)3)28-25(17-8-6-5-7-9-17)29-24(22)16-10-12-18(27)13-11-16/h4-13,15,19-21,30-31H,1,14H2,2-3H3,(H,32,33)