tert-butyl 4-[5-chloranyl-3-(2-chlorophenyl)-2-oxidanylidene-1H-indol-3-yl]piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[5-chloranyl-3-(2-chlorophenyl)-2-oxidanylidene-1H-indol-3-yl]piperazine-1-carboxylate Openeye Name: tert-butyl 4-[5-chloro-3-(2-chlorophenyl)-2-oxo-indolin-3-yl]piperazine-1-carboxylate CAS Name: 4-[5-chloro-3-(2-chlorophenyl)-2-oxo-1H-indol-3-yl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[5-chloro-3-(2-chlorophenyl)-2-oxo-1H-indol-3-yl]piperazine-1-carboxylate Traditional Name: 4-[5-chloro-3-(2-chlorophenyl)-2-keto-indolin-3-yl]piperazine-1-carboxylic acid tert-butyl ester Formula: C23H25Cl2N3O3 MolecularWeight: 462.3689

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)C2(C3=C(C=CC(=C3)Cl)NC2=O)C4=CC=CC=C4Cl

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)C2(C3=C(C=CC(=C3)Cl)NC2=O)C4=CC=CC=C4Cl

InChI

InChI=1S/C23H25Cl2N3O3/c1-22(2,3)31-21(30)27-10-12-28(13-11-27)23(16-6-4-5-7-18(16)25)17-14-15(24)8-9-19(17)26-20(23)29/h4-9,14H,10-13H2,1-3H3,(H,26,29)