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

Systemtic Name: 2-bromanyl-N-[3-chloranyl-4-[4-(3-methylbutanoyl)piperazin-1-yl]phenyl]benzamide Openeye Name: 2-bromo-N-[3-chloro-4-[4-(3-methylbutanoyl)piperazin-1-yl]phenyl]benzamide CAS Name: 2-bromo-N-[3-chloro-4-[4-(3-methyl-1-oxobutyl)-1-piperazinyl]phenyl]benzamide IUPAC Name: 2-bromo-N-[3-chloro-4-[4-(3-methylbutanoyl)piperazin-1-yl]phenyl]benzamide Traditional Name: 2-bromo-N-[3-chloro-4-(4-isovalerylpiperazino)phenyl]benzamide Formula: C22H25BrClN3O2 MolecularWeight: 478.8098

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)N1CCN(CC1)C2=C(C=C(C=C2)NC(=O)C3=CC=CC=C3Br)Cl

Isomeric SMILES

CC(C)CC(=O)N1CCN(CC1)C2=C(C=C(C=C2)NC(=O)C3=CC=CC=C3Br)Cl

InChI

InChI=1S/C22H25BrClN3O2/c1-15(2)13-21(28)27-11-9-26(10-12-27)20-8-7-16(14-19(20)24)25-22(29)17-5-3-4-6-18(17)23/h3-8,14-15H,9-13H2,1-2H3,(H,25,29)