1-(2-chloroethylsulfanyl)-4-methylsulfonyl-2-nitro-benzene

Systemtic Name: 1-(2-chloroethylsulfanyl)-4-methylsulfonyl-2-nitro-benzene Openeye Name: 1-(2-chloroethylsulfanyl)-4-methylsulfonyl-2-nitro-benzene CAS Name: 1-(2-chloroethylthio)-4-methylsulfonyl-2-nitrobenzene IUPAC Name: 1-(2-chloroethylsulfanyl)-4-methylsulfonyl-2-nitrobenzene Traditional Name: 1-(2-chloroethylthio)-4-mesyl-2-nitro-benzene Formula: C9H10ClNO4S2 MolecularWeight: 295.763

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC(=C(C=C1)SCCCl)[N+](=O)[O-]

Isomeric SMILES

CS(=O)(=O)C1=CC(=C(C=C1)SCCCl)[N+](=O)[O-]

InChI

InChI=1S/C9H10ClNO4S2/c1-17(14,15)7-2-3-9(16-5-4-10)8(6-7)11(12)13/h2-3,6H,4-5H2,1H3