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

Systemtic Name: 3,5-bis(bromanyl)-2-iodanyl-N-[4-[4-(3-methylbutanoyl)piperazin-1-yl]phenyl]benzamide Openeye Name: 3,5-dibromo-2-iodo-N-[4-[4-(3-methylbutanoyl)piperazin-1-yl]phenyl]benzamide CAS Name: 3,5-dibromo-2-iodo-N-[4-[4-(3-methyl-1-oxobutyl)-1-piperazinyl]phenyl]benzamide IUPAC Name: 3,5-dibromo-2-iodo-N-[4-[4-(3-methylbutanoyl)piperazin-1-yl]phenyl]benzamide Traditional Name: 3,5-dibromo-2-iodo-N-[4-(4-isovalerylpiperazino)phenyl]benzamide Formula: C22H24Br2IN3O2 MolecularWeight: 649.15733

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H24Br2IN3O2/c1-14(2)11-20(29)28-9-7-27(8-10-28)17-5-3-16(4-6-17)26-22(30)18-12-15(23)13-19(24)21(18)25/h3-6,12-14H,7-11H2,1-2H3,(H,26,30)