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

Systemtic Name: diethyl 2-[2-(4-bromophenyl)carbonyl-6-chloranyl-1H-indol-3-yl]propanedioate Openeye Name: diethyl 2-[2-(4-bromobenzoyl)-6-chloro-1H-indol-3-yl]propanedioate CAS Name: 2-[2-[(4-bromophenyl)-oxomethyl]-6-chloro-1H-indol-3-yl]propanedioic acid diethyl ester IUPAC Name: diethyl 2-[2-(4-bromobenzoyl)-6-chloro-1H-indol-3-yl]propanedioate Traditional Name: 2-[2-(4-bromobenzoyl)-6-chloro-1H-indol-3-yl]malonic acid diethyl ester Formula: C22H19BrClNO5 MolecularWeight: 492.74696

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H19BrClNO5/c1-3-29-21(27)18(22(28)30-4-2)17-15-10-9-14(24)11-16(15)25-19(17)20(26)12-5-7-13(23)8-6-12/h5-11,18,25H,3-4H2,1-2H3