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

Systemtic Name: tert-butyl 4-[3-[5-chloranyl-2-(4-chlorophenyl)-1H-indol-3-yl]propanoyl]piperazine-1-carboxylate Openeye Name: tert-butyl 4-[3-[5-chloro-2-(4-chlorophenyl)-1H-indol-3-yl]propanoyl]piperazine-1-carboxylate CAS Name: 4-[3-[5-chloro-2-(4-chlorophenyl)-1H-indol-3-yl]-1-oxopropyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[3-[5-chloro-2-(4-chlorophenyl)-1H-indol-3-yl]propanoyl]piperazine-1-carboxylate Traditional Name: 4-[3-[5-chloro-2-(4-chlorophenyl)-1H-indol-3-yl]propanoyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C26H29Cl2N3O3 MolecularWeight: 502.43276

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)C(=O)CCC2=C(NC3=C2C=C(C=C3)Cl)C4=CC=C(C=C4)Cl

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)C(=O)CCC2=C(NC3=C2C=C(C=C3)Cl)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C26H29Cl2N3O3/c1-26(2,3)34-25(33)31-14-12-30(13-15-31)23(32)11-9-20-21-16-19(28)8-10-22(21)29-24(20)17-4-6-18(27)7-5-17/h4-8,10,16,29H,9,11-15H2,1-3H3