3,5-bis(bromanyl)-N-[4-(4-butanoylpiperazin-1-yl)phenyl]-2-iodanyl-benzamide

Systemtic Name: 3,5-bis(bromanyl)-N-[4-(4-butanoylpiperazin-1-yl)phenyl]-2-iodanyl-benzamide Openeye Name: 3,5-dibromo-N-[4-(4-butanoylpiperazin-1-yl)phenyl]-2-iodo-benzamide CAS Name: 3,5-dibromo-2-iodo-N-[4-[4-(1-oxobutyl)-1-piperazinyl]phenyl]benzamide IUPAC Name: 3,5-dibromo-N-[4-(4-butanoylpiperazin-1-yl)phenyl]-2-iodobenzamide Traditional Name: 3,5-dibromo-N-[4-(4-butyrylpiperazino)phenyl]-2-iodo-benzamide Formula: C21H22Br2IN3O2 MolecularWeight: 635.13075

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)N1CCN(CC1)C2=CC=C(C=C2)NC(=O)C3=CC(=CC(=C3I)Br)Br

Isomeric SMILES

CCCC(=O)N1CCN(CC1)C2=CC=C(C=C2)NC(=O)C3=CC(=CC(=C3I)Br)Br

InChI

InChI=1S/C21H22Br2IN3O2/c1-2-3-19(28)27-10-8-26(9-11-27)16-6-4-15(5-7-16)25-21(29)17-12-14(22)13-18(23)20(17)24/h4-7,12-13H,2-3,8-11H2,1H3,(H,25,29)