diethyl 2-[2-(4-chlorophenyl)carbonyl-6-(trifluoromethyl)-1H-indol-3-yl]propanedioate

Systemtic Name: diethyl 2-[2-(4-chlorophenyl)carbonyl-6-(trifluoromethyl)-1H-indol-3-yl]propanedioate Openeye Name: diethyl 2-[2-(4-chlorobenzoyl)-6-(trifluoromethyl)-1H-indol-3-yl]propanedioate CAS Name: 2-[2-[(4-chlorophenyl)-oxomethyl]-6-(trifluoromethyl)-1H-indol-3-yl]propanedioic acid diethyl ester IUPAC Name: diethyl 2-[2-(4-chlorobenzoyl)-6-(trifluoromethyl)-1H-indol-3-yl]propanedioate Traditional Name: 2-[2-(4-chlorobenzoyl)-6-(trifluoromethyl)-1H-indol-3-yl]malonic acid diethyl ester Formula: C23H19ClF3NO5 MolecularWeight: 481.84887

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C1=C(NC2=C1C=CC(=C2)C(F)(F)F)C(=O)C3=CC=C(C=C3)Cl)C(=O)OCC

Isomeric SMILES

CCOC(=O)C(C1=C(NC2=C1C=CC(=C2)C(F)(F)F)C(=O)C3=CC=C(C=C3)Cl)C(=O)OCC

InChI

InChI=1S/C23H19ClF3NO5/c1-3-32-21(30)18(22(31)33-4-2)17-15-10-7-13(23(25,26)27)11-16(15)28-19(17)20(29)12-5-8-14(24)9-6-12/h5-11,18,28H,3-4H2,1-2H3