tert-butyl 4-[1-(4-iodophenyl)-3-methanoyl-indol-2-yl]piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[1-(4-iodophenyl)-3-methanoyl-indol-2-yl]piperazine-1-carboxylate Openeye Name: tert-butyl 4-[3-formyl-1-(4-iodophenyl)indol-2-yl]piperazine-1-carboxylate CAS Name: 4-[3-formyl-1-(4-iodophenyl)-2-indolyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[3-formyl-1-(4-iodophenyl)indol-2-yl]piperazine-1-carboxylate Traditional Name: 4-[3-formyl-1-(4-iodophenyl)indol-2-yl]piperazine-1-carboxylic acid tert-butyl ester Formula: C24H26IN3O3 MolecularWeight: 531.38601

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)C2=C(C3=CC=CC=C3N2C4=CC=C(C=C4)I)C=O

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)C2=C(C3=CC=CC=C3N2C4=CC=C(C=C4)I)C=O

InChI

InChI=1S/C24H26IN3O3/c1-24(2,3)31-23(30)27-14-12-26(13-15-27)22-20(16-29)19-6-4-5-7-21(19)28(22)18-10-8-17(25)9-11-18/h4-11,16H,12-15H2,1-3H3