4-bromanyl-N-[4-[4-(2-methylpropanoyl)piperazin-1-yl]phenyl]benzamide

Systemtic Name: 4-bromanyl-N-[4-[4-(2-methylpropanoyl)piperazin-1-yl]phenyl]benzamide Openeye Name: 4-bromo-N-[4-[4-(2-methylpropanoyl)piperazin-1-yl]phenyl]benzamide CAS Name: 4-bromo-N-[4-[4-(2-methyl-1-oxopropyl)-1-piperazinyl]phenyl]benzamide IUPAC Name: 4-bromo-N-[4-[4-(2-methylpropanoyl)piperazin-1-yl]phenyl]benzamide Traditional Name: 4-bromo-N-[4-(4-isobutyrylpiperazino)phenyl]benzamide Formula: C21H24BrN3O2 MolecularWeight: 430.33816

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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