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

Systemtic Name: N-[2,2-bis(chloranyl)-1-isothiocyanato-ethyl]-4-chloranyl-benzamide Openeye Name: 4-chloro-N-(2,2-dichloro-1-isothiocyanato-ethyl)benzamide CAS Name: 4-chloro-N-(2,2-dichloro-1-isothiocyanatoethyl)benzamide IUPAC Name: 4-chloro-N-(2,2-dichloro-1-isothiocyanatoethyl)benzamide Traditional Name: 4-chloro-N-(2,2-dichloro-1-isothiocyanato-ethyl)benzamide Formula: C10H7Cl3N2OS MolecularWeight: 309.59938

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H7Cl3N2OS/c11-7-3-1-6(2-4-7)10(16)15-9(8(12)13)14-5-17/h1-4,8-9H,(H,15,16)