2-(4-chlorophenyl)sulfonyl-1-isocyanato-ethanone

Systemtic Name: 2-(4-chlorophenyl)sulfonyl-1-isocyanato-ethanone Openeye Name: 2-(4-chlorophenyl)sulfonylacetyl isocyanate CAS Name: 2-(4-chlorophenyl)sulfonyl-1-isocyanatoethanone IUPAC Name: 2-(4-chlorophenyl)sulfonylacetyl isocyanate Traditional Name: 2-(4-chlorophenyl)sulfonyl-1-isocyanato-ethanone Formula: C9H6ClNO4S MolecularWeight: 259.66624

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1S(=O)(=O)CC(=O)N=C=O)Cl

Isomeric SMILES

C1=CC(=CC=C1S(=O)(=O)CC(=O)N=C=O)Cl

InChI

InChI=1S/C9H6ClNO4S/c10-7-1-3-8(4-2-7)16(14,15)5-9(13)11-6-12/h1-4H,5H2