4-(3-bromanyl-4-iodanyl-phenyl)carbonyl-N,N-diethyl-piperazine-1-carboxamide

Systemtic Name: 4-(3-bromanyl-4-iodanyl-phenyl)carbonyl-N,N-diethyl-piperazine-1-carboxamide Openeye Name: 4-(3-bromo-4-iodo-benzoyl)-N,N-diethyl-piperazine-1-carboxamide CAS Name: 4-[(3-bromo-4-iodophenyl)-oxomethyl]-N,N-diethyl-1-piperazinecarboxamide IUPAC Name: 4-(3-bromo-4-iodobenzoyl)-N,N-diethylpiperazine-1-carboxamide Traditional Name: 4-(3-bromo-4-iodo-benzoyl)-N,N-diethyl-piperazine-1-carboxamide Formula: C16H21BrIN3O2 MolecularWeight: 494.16531

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)N1CCN(CC1)C(=O)C2=CC(=C(C=C2)I)Br

Isomeric SMILES

CCN(CC)C(=O)N1CCN(CC1)C(=O)C2=CC(=C(C=C2)I)Br

InChI

InChI=1S/C16H21BrIN3O2/c1-3-19(4-2)16(23)21-9-7-20(8-10-21)15(22)12-5-6-14(18)13(17)11-12/h5-6,11H,3-4,7-10H2,1-2H3