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

Systemtic Name: 3-bromanyl-N-[3-chloranyl-2-[4-(2-methylpropanoyl)piperazin-1-yl]phenyl]benzamide Openeye Name: 3-bromo-N-[3-chloro-2-[4-(2-methylpropanoyl)piperazin-1-yl]phenyl]benzamide CAS Name: 3-bromo-N-[3-chloro-2-[4-(2-methyl-1-oxopropyl)-1-piperazinyl]phenyl]benzamide IUPAC Name: 3-bromo-N-[3-chloro-2-[4-(2-methylpropanoyl)piperazin-1-yl]phenyl]benzamide Traditional Name: 3-bromo-N-[3-chloro-2-(4-isobutyrylpiperazino)phenyl]benzamide Formula: C21H23BrClN3O2 MolecularWeight: 464.78322

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)N1CCN(CC1)C2=C(C=CC=C2Cl)NC(=O)C3=CC(=CC=C3)Br

Isomeric SMILES

CC(C)C(=O)N1CCN(CC1)C2=C(C=CC=C2Cl)NC(=O)C3=CC(=CC=C3)Br

InChI

InChI=1S/C21H23BrClN3O2/c1-14(2)21(28)26-11-9-25(10-12-26)19-17(23)7-4-8-18(19)24-20(27)15-5-3-6-16(22)13-15/h3-8,13-14H,9-12H2,1-2H3,(H,24,27)