diethyl 2-[4,5-bis(chloranyl)-2-(phenylcarbonyl)-1H-indol-3-yl]propanedioate

Systemtic Name: diethyl 2-[4,5-bis(chloranyl)-2-(phenylcarbonyl)-1H-indol-3-yl]propanedioate Openeye Name: diethyl 2-(2-benzoyl-4,5-dichloro-1H-indol-3-yl)propanedioate CAS Name: 2-(2-benzoyl-4,5-dichloro-1H-indol-3-yl)propanedioic acid diethyl ester IUPAC Name: diethyl 2-(2-benzoyl-4,5-dichloro-1H-indol-3-yl)propanedioate Traditional Name: 2-(2-benzoyl-4,5-dichloro-1H-indol-3-yl)malonic acid diethyl ester Formula: C22H19Cl2NO5 MolecularWeight: 448.29596

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H19Cl2NO5/c1-3-29-21(27)17(22(28)30-4-2)16-15-14(11-10-13(23)18(15)24)25-19(16)20(26)12-8-6-5-7-9-12/h5-11,17,25H,3-4H2,1-2H3