4-iodanyl-N-[2,2,2-tris(chloranyl)-1-isothiocyanato-ethyl]benzamide

Systemtic Name: 4-iodanyl-N-[2,2,2-tris(chloranyl)-1-isothiocyanato-ethyl]benzamide Openeye Name: 4-iodo-N-(2,2,2-trichloro-1-isothiocyanato-ethyl)benzamide CAS Name: 4-iodo-N-(2,2,2-trichloro-1-isothiocyanatoethyl)benzamide IUPAC Name: 4-iodo-N-(2,2,2-trichloro-1-isothiocyanatoethyl)benzamide Traditional Name: 4-iodo-N-(2,2,2-trichloro-1-isothiocyanato-ethyl)benzamide Formula: C10H6Cl3IN2OS MolecularWeight: 435.49591

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)NC(C(Cl)(Cl)Cl)N=C=S)I

Isomeric SMILES

C1=CC(=CC=C1C(=O)NC(C(Cl)(Cl)Cl)N=C=S)I

InChI

InChI=1S/C10H6Cl3IN2OS/c11-10(12,13)9(15-5-18)16-8(17)6-1-3-7(14)4-2-6/h1-4,9H,(H,16,17)