2-chloranyl-N-[3-chloranyl-2-[4-(2-methylpropanoyl)piperazin-1-yl]phenyl]-5-iodanyl-benzamide

Systemtic Name: 2-chloranyl-N-[3-chloranyl-2-[4-(2-methylpropanoyl)piperazin-1-yl]phenyl]-5-iodanyl-benzamide Openeye Name: 2-chloro-N-[3-chloro-2-[4-(2-methylpropanoyl)piperazin-1-yl]phenyl]-5-iodo-benzamide CAS Name: 2-chloro-N-[3-chloro-2-[4-(2-methyl-1-oxopropyl)-1-piperazinyl]phenyl]-5-iodobenzamide IUPAC Name: 2-chloro-N-[3-chloro-2-[4-(2-methylpropanoyl)piperazin-1-yl]phenyl]-5-iodobenzamide Traditional Name: 2-chloro-N-[3-chloro-2-(4-isobutyrylpiperazino)phenyl]-5-iodo-benzamide Formula: C21H22Cl2IN3O2 MolecularWeight: 546.22875

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H22Cl2IN3O2/c1-13(2)21(29)27-10-8-26(9-11-27)19-17(23)4-3-5-18(19)25-20(28)15-12-14(24)6-7-16(15)22/h3-7,12-13H,8-11H2,1-2H3,(H,25,28)