tert-butyl 2-[3-(2-chloranyl-2-oxidanylidene-ethanoyl)-2-ethyl-1-(phenylcarbonyl)indol-4-yl]oxyethanoate

Systemtic Name: tert-butyl 2-[3-(2-chloranyl-2-oxidanylidene-ethanoyl)-2-ethyl-1-(phenylcarbonyl)indol-4-yl]oxyethanoate Openeye Name: tert-butyl 2-[1-benzoyl-3-(2-chloro-2-oxo-acetyl)-2-ethyl-indol-4-yl]oxyacetate CAS Name: 2-[[1-benzoyl-3-(2-chloro-1,2-dioxoethyl)-2-ethyl-4-indolyl]oxy]acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-[1-benzoyl-3-(2-chloro-2-oxoacetyl)-2-ethylindol-4-yl]oxyacetate Traditional Name: 2-[1-benzoyl-3-(2-chloro-2-keto-acetyl)-2-ethyl-indol-4-yl]oxyacetic acid tert-butyl ester Formula: C25H24ClNO6 MolecularWeight: 469.91416

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C2=C(N1C(=O)C3=CC=CC=C3)C=CC=C2OCC(=O)OC(C)(C)C)C(=O)C(=O)Cl

Isomeric SMILES

CCC1=C(C2=C(N1C(=O)C3=CC=CC=C3)C=CC=C2OCC(=O)OC(C)(C)C)C(=O)C(=O)Cl

InChI

InChI=1S/C25H24ClNO6/c1-5-16-21(22(29)23(26)30)20-17(27(16)24(31)15-10-7-6-8-11-15)12-9-13-18(20)32-14-19(28)33-25(2,3)4/h6-13H,5,14H2,1-4H3