butyl (E)-8-[4,6-bis(4-fluorophenyl)-2-propan-2-yl-4H-pyrimidin-3-yl]-7-fluoranyl-6-oxidanyl-4-oxidanylidene-oct-7-enoate

Systemtic Name: butyl (E)-8-[4,6-bis(4-fluorophenyl)-2-propan-2-yl-4H-pyrimidin-3-yl]-7-fluoranyl-6-oxidanyl-4-oxidanylidene-oct-7-enoate Openeye Name: butyl (E)-8-[4,6-bis(4-fluorophenyl)-2-isopropyl-4H-pyrimidin-3-yl]-7-fluoro-6-hydroxy-4-oxo-oct-7-enoate CAS Name: (E)-8-[4,6-bis(4-fluorophenyl)-2-propan-2-yl-4H-pyrimidin-3-yl]-7-fluoro-6-hydroxy-4-oxo-7-octenoic acid butyl ester IUPAC Name: butyl (E)-8-[4,6-bis(4-fluorophenyl)-2-propan-2-yl-4H-pyrimidin-3-yl]-7-fluoro-6-hydroxy-4-oxooct-7-enoate Traditional Name: (E)-8-[4,6-bis(4-fluorophenyl)-2-isopropyl-4H-pyrimidin-3-yl]-7-fluoro-6-hydroxy-4-keto-oct-7-enoic acid butyl ester Formula: C31H35F3N2O4 MolecularWeight: 556.61581

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)CCC(=O)CC(C(=CN1C(C=C(N=C1C(C)C)C2=CC=C(C=C2)F)C3=CC=C(C=C3)F)F)O

Isomeric SMILES

CCCCOC(=O)CCC(=O)CC(/C(=C\N1C(C=C(N=C1C(C)C)C2=CC=C(C=C2)F)C3=CC=C(C=C3)F)/F)O

InChI

InChI=1S/C31H35F3N2O4/c1-4-5-16-40-30(39)15-14-25(37)17-29(38)26(34)19-36-28(22-8-12-24(33)13-9-22)18-27(35-31(36)20(2)3)21-6-10-23(32)11-7-21/h6-13,18-20,28-29,38H,4-5,14-17H2,1-3H3/b26-19+