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

Systemtic Name: diethyl 2-acetyloxy-2-[4,5-bis(chloranyl)-2-(phenylcarbonyl)-1H-indol-3-yl]propanedioate Openeye Name: diethyl 2-acetoxy-2-(2-benzoyl-4,5-dichloro-1H-indol-3-yl)propanedioate CAS Name: 2-acetyloxy-2-(2-benzoyl-4,5-dichloro-1H-indol-3-yl)propanedioic acid diethyl ester IUPAC Name: diethyl 2-acetyloxy-2-(2-benzoyl-4,5-dichloro-1H-indol-3-yl)propanedioate Traditional Name: 2-acetoxy-2-(2-benzoyl-4,5-dichloro-1H-indol-3-yl)malonic acid diethyl ester Formula: C24H21Cl2NO7 MolecularWeight: 506.33204

Click to see the large picture

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)OC(=O)C

Isomeric SMILES

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

InChI

InChI=1S/C24H21Cl2NO7/c1-4-32-22(30)24(34-13(3)28,23(31)33-5-2)18-17-16(12-11-15(25)19(17)26)27-20(18)21(29)14-9-7-6-8-10-14/h6-12,27H,4-5H2,1-3H3