N-[3-chloranyl-2-[4-(4-methylphenyl)carbonylpiperazin-1-yl]phenyl]-2-iodanyl-benzamide

Systemtic Name: N-[3-chloranyl-2-[4-(4-methylphenyl)carbonylpiperazin-1-yl]phenyl]-2-iodanyl-benzamide Openeye Name: N-[3-chloro-2-[4-(4-methylbenzoyl)piperazin-1-yl]phenyl]-2-iodo-benzamide CAS Name: N-[3-chloro-2-[4-[(4-methylphenyl)-oxomethyl]-1-piperazinyl]phenyl]-2-iodobenzamide IUPAC Name: N-[3-chloro-2-[4-(4-methylbenzoyl)piperazin-1-yl]phenyl]-2-iodobenzamide Traditional Name: N-[3-chloro-2-(4-p-toluoylpiperazino)phenyl]-2-iodo-benzamide Formula: C25H23ClIN3O2 MolecularWeight: 559.82649

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=C(C=CC=C3Cl)NC(=O)C4=CC=CC=C4I

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=C(C=CC=C3Cl)NC(=O)C4=CC=CC=C4I

InChI

InChI=1S/C25H23ClIN3O2/c1-17-9-11-18(12-10-17)25(32)30-15-13-29(14-16-30)23-20(26)6-4-8-22(23)28-24(31)19-5-2-3-7-21(19)27/h2-12H,13-16H2,1H3,(H,28,31)