3-METHYL(E)-7-[3-(4-FLUOROPHENYL)-1-METHYLETHYL-INDOL-2-YL]-3-HYDROXY-5-OXOHEPT-6-ENOATE

CAS No.
93957-52-9
CCD No.
CCD00783687
Formula
C25 H26 F N O4
MolWeight
423.481

Basic Information

Product Name: 3-METHYL(E)-7-[3-(4-FLUOROPHENYL)-1-METHYLETHYL-INDOL-2-YL]-3-HYDROXY-5-OXOHEPT-6-ENOATE
CAS: 93957-52-9
English Synonyms: METHYL(E)-7-[3-(4-FLUOROPHENYL)-1-(1-METHYLETHYL)-1H-INDOL-2-YL]-5-HYDROXY-3-OXO-6-HEPTENOATE ; 3-METHYL(E)-7-[3-(4-FLUOROPHENYL)-1-METHYLETHYL-INDOL-2-YL]-3-HYDROXY-5-OXOHEPT-6-ENOATE ; METHYL-(+/-)-(E)-7-[3'-(4''-FLUOROPHENYL)-1'-(1''-METHYLETHYL)INDOL-2'-YL]-5-HYDROXY-3-OXOHEPT-6-ENOATE ; METHYL-(+/-)-(E)-7-[3'-(4-FLUOROPHENYL)-1'-(1-METHYLETHYL)INDOL-2'-YL]-5-HYDROXY-3-OXOHEPT-6-ENOATE ; METHYL-(+/-)-(E)-7-[3'-(4'-FLUOROPHENYL)-1'-(1'-METHYLETHYL)INDOL-2'-YL]-5HYDROXY-3-OXOHEPT-6-ENOATE ; FHH
MDL Number.: MFCD09753124
H bond acceptor: 5
H bond donor: 1
Smile: CC(C)n1c2ccccc2c(c1/C=C/C(=O)CC(CC(=O)OC)O)c3ccc(cc3)F
InChi: InChI=1S/C25H26FNO4/c1-16(2)27-22-7-5-4-6-21(22)25(17-8-10-18(26)11-9-17)23(27)13-12-19(28)14-20(29)15-24(30)31-3/h4-13,16,20,29H,14-15H2,1-3H3/b13-12+
InChiKey: InChIKey=KYRVMHRSMHMKAP-OUKQBFOZSA-N

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