N-[3-chloranyl-4-(3-oxidanylidenepiperazin-1-yl)phenyl]-3-iodanyl-benzamide

Systemtic Name: N-[3-chloranyl-4-(3-oxidanylidenepiperazin-1-yl)phenyl]-3-iodanyl-benzamide Openeye Name: N-[3-chloro-4-(3-oxopiperazin-1-yl)phenyl]-3-iodo-benzamide CAS Name: N-[3-chloro-4-(3-oxo-1-piperazinyl)phenyl]-3-iodobenzamide IUPAC Name: N-[3-chloro-4-(3-oxopiperazin-1-yl)phenyl]-3-iodobenzamide Traditional Name: N-[3-chloro-4-(3-ketopiperazino)phenyl]-3-iodo-benzamide Formula: C17H15ClIN3O2 MolecularWeight: 455.67737

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC(=O)N1)C2=C(C=C(C=C2)NC(=O)C3=CC(=CC=C3)I)Cl

Isomeric SMILES

C1CN(CC(=O)N1)C2=C(C=C(C=C2)NC(=O)C3=CC(=CC=C3)I)Cl

InChI

InChI=1S/C17H15ClIN3O2/c18-14-9-13(21-17(24)11-2-1-3-12(19)8-11)4-5-15(14)22-7-6-20-16(23)10-22/h1-5,8-9H,6-7,10H2,(H,20,23)(H,21,24)