O1-(6-chloranyl-1H-indol-3-yl) O3-ethyl 2-(3,4-dichlorophenyl)carbonyl-2-ethyl-propanedioate

Systemtic Name: O1-(6-chloranyl-1H-indol-3-yl) O3-ethyl 2-(3,4-dichlorophenyl)carbonyl-2-ethyl-propanedioate Openeye Name: O1-(6-chloro-1H-indol-3-yl) O3-ethyl 2-(3,4-dichlorobenzoyl)-2-ethyl-propanedioate CAS Name: 2-[(3,4-dichlorophenyl)-oxomethyl]-2-ethylpropanedioic acid O1-(6-chloro-1H-indol-3-yl) ester O3-ethyl ester IUPAC Name: 1-O-(6-chloro-1H-indol-3-yl) 3-O-ethyl 2-(3,4-dichlorobenzoyl)-2-ethylpropanedioate Traditional Name: 2-(3,4-dichlorobenzoyl)-2-ethyl-malonic acid O1-(6-chloro-1H-indol-3-yl) ester O3-ethyl ester Formula: C22H18Cl3NO5 MolecularWeight: 482.74102

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)C1=CC(=C(C=C1)Cl)Cl)(C(=O)OCC)C(=O)OC2=CNC3=C2C=CC(=C3)Cl

Isomeric SMILES

CCC(C(=O)C1=CC(=C(C=C1)Cl)Cl)(C(=O)OCC)C(=O)OC2=CNC3=C2C=CC(=C3)Cl

InChI

InChI=1S/C22H18Cl3NO5/c1-3-22(20(28)30-4-2,19(27)12-5-8-15(24)16(25)9-12)21(29)31-18-11-26-17-10-13(23)6-7-14(17)18/h5-11,26H,3-4H2,1-2H3