(4-methylcyclohexyl) 4-[2-[2-methyl-5-(trifluoromethyloxy)-1H-indol-3-yl]ethylamino]-4-oxidanylidene-butanoate

Systemtic Name: (4-methylcyclohexyl) 4-[2-[2-methyl-5-(trifluoromethyloxy)-1H-indol-3-yl]ethylamino]-4-oxidanylidene-butanoate Openeye Name: (4-methylcyclohexyl) 4-[2-[2-methyl-5-(trifluoromethoxy)-1H-indol-3-yl]ethylamino]-4-oxo-butanoate CAS Name: 4-[2-[2-methyl-5-(trifluoromethoxy)-1H-indol-3-yl]ethylamino]-4-oxobutanoic acid (4-methylcyclohexyl) ester IUPAC Name: (4-methylcyclohexyl) 4-[2-[2-methyl-5-(trifluoromethoxy)-1H-indol-3-yl]ethylamino]-4-oxobutanoate Traditional Name: 4-keto-4-[2-[2-methyl-5-(trifluoromethoxy)-1H-indol-3-yl]ethylamino]butyric acid (4-methylcyclohexyl) ester Formula: C23H29F3N2O4 MolecularWeight: 454.48257

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(CC1)OC(=O)CCC(=O)NCCC2=C(NC3=C2C=C(C=C3)OC(F)(F)F)C

Isomeric SMILES

CC1CCC(CC1)OC(=O)CCC(=O)NCCC2=C(NC3=C2C=C(C=C3)OC(F)(F)F)C

InChI

InChI=1S/C23H29F3N2O4/c1-14-3-5-16(6-4-14)31-22(30)10-9-21(29)27-12-11-18-15(2)28-20-8-7-17(13-19(18)20)32-23(24,25)26/h7-8,13-14,16,28H,3-6,9-12H2,1-2H3,(H,27,29)