2-butanoyl-3-[2-[2-methyl-5-(trifluoromethyloxy)-1H-indol-3-yl]ethylamino]-5-phenyl-cyclohex-2-en-1-one

Systemtic Name: 2-butanoyl-3-[2-[2-methyl-5-(trifluoromethyloxy)-1H-indol-3-yl]ethylamino]-5-phenyl-cyclohex-2-en-1-one Openeye Name: 2-butanoyl-3-[2-[2-methyl-5-(trifluoromethoxy)-1H-indol-3-yl]ethylamino]-5-phenyl-cyclohex-2-en-1-one CAS Name: 3-[2-[2-methyl-5-(trifluoromethoxy)-1H-indol-3-yl]ethylamino]-2-(1-oxobutyl)-5-phenyl-1-cyclohex-2-enone IUPAC Name: 2-butanoyl-3-[2-[2-methyl-5-(trifluoromethoxy)-1H-indol-3-yl]ethylamino]-5-phenylcyclohex-2-en-1-one Traditional Name: 2-butyryl-3-[2-[2-methyl-5-(trifluoromethoxy)-1H-indol-3-yl]ethylamino]-5-phenyl-cyclohex-2-en-1-one Formula: C28H29F3N2O3 MolecularWeight: 498.53667

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)C1=C(CC(CC1=O)C2=CC=CC=C2)NCCC3=C(NC4=C3C=C(C=C4)OC(F)(F)F)C

Isomeric SMILES

CCCC(=O)C1=C(CC(CC1=O)C2=CC=CC=C2)NCCC3=C(NC4=C3C=C(C=C4)OC(F)(F)F)C

InChI

InChI=1S/C28H29F3N2O3/c1-3-7-25(34)27-24(14-19(15-26(27)35)18-8-5-4-6-9-18)32-13-12-21-17(2)33-23-11-10-20(16-22(21)23)36-28(29,30)31/h4-6,8-11,16,19,32-33H,3,7,12-15H2,1-2H3