3-bromanyl-N-[4-(4-butanoylpiperazin-1-yl)phenyl]benzamide

Systemtic Name: 3-bromanyl-N-[4-(4-butanoylpiperazin-1-yl)phenyl]benzamide Openeye Name: 3-bromo-N-[4-(4-butanoylpiperazin-1-yl)phenyl]benzamide CAS Name: 3-bromo-N-[4-[4-(1-oxobutyl)-1-piperazinyl]phenyl]benzamide IUPAC Name: 3-bromo-N-[4-(4-butanoylpiperazin-1-yl)phenyl]benzamide Traditional Name: 3-bromo-N-[4-(4-butyrylpiperazino)phenyl]benzamide Formula: C21H24BrN3O2 MolecularWeight: 430.33816

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H24BrN3O2/c1-2-4-20(26)25-13-11-24(12-14-25)19-9-7-18(8-10-19)23-21(27)16-5-3-6-17(22)15-16/h3,5-10,15H,2,4,11-14H2,1H3,(H,23,27)