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

Systemtic Name: 3-bromanyl-N-[2-[4-(2-methylpropanoyl)piperazin-1-yl]phenyl]benzamide Openeye Name: 3-bromo-N-[2-[4-(2-methylpropanoyl)piperazin-1-yl]phenyl]benzamide CAS Name: 3-bromo-N-[2-[4-(2-methyl-1-oxopropyl)-1-piperazinyl]phenyl]benzamide IUPAC Name: 3-bromo-N-[2-[4-(2-methylpropanoyl)piperazin-1-yl]phenyl]benzamide Traditional Name: 3-bromo-N-[2-(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=CC=C2NC(=O)C3=CC(=CC=C3)Br

Isomeric SMILES

CC(C)C(=O)N1CCN(CC1)C2=CC=CC=C2NC(=O)C3=CC(=CC=C3)Br

InChI

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