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

Systemtic Name: 3-bromanyl-N-[3-chloranyl-4-[4-(phenylcarbonyl)piperazin-1-yl]phenyl]benzamide Openeye Name: N-[4-(4-benzoylpiperazin-1-yl)-3-chloro-phenyl]-3-bromo-benzamide CAS Name: N-[4-(4-benzoyl-1-piperazinyl)-3-chlorophenyl]-3-bromobenzamide IUPAC Name: N-[4-(4-benzoylpiperazin-1-yl)-3-chlorophenyl]-3-bromobenzamide Traditional Name: N-[4-(4-benzoylpiperazino)-3-chloro-phenyl]-3-bromo-benzamide Formula: C24H21BrClN3O2 MolecularWeight: 498.79944

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C=C(C=C2)NC(=O)C3=CC(=CC=C3)Br)Cl)C(=O)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1C2=C(C=C(C=C2)NC(=O)C3=CC(=CC=C3)Br)Cl)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C24H21BrClN3O2/c25-19-8-4-7-18(15-19)23(30)27-20-9-10-22(21(26)16-20)28-11-13-29(14-12-28)24(31)17-5-2-1-3-6-17/h1-10,15-16H,11-14H2,(H,27,30)