1-(2-chloranyl-2-hexylsulfonyl-ethyl)sulfanyl-2-nitro-benzene

Systemtic Name: 1-(2-chloranyl-2-hexylsulfonyl-ethyl)sulfanyl-2-nitro-benzene Openeye Name: 1-(2-chloro-2-hexylsulfonyl-ethyl)sulfanyl-2-nitro-benzene CAS Name: 1-[(2-chloro-2-hexylsulfonylethyl)thio]-2-nitrobenzene IUPAC Name: 1-(2-chloro-2-hexylsulfonylethyl)sulfanyl-2-nitrobenzene Traditional Name: 1-[(2-chloro-2-hexylsulfonyl-ethyl)thio]-2-nitro-benzene Formula: C14H20ClNO4S2 MolecularWeight: 365.8959

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCS(=O)(=O)C(CSC1=CC=CC=C1[N+](=O)[O-])Cl

Isomeric SMILES

CCCCCCS(=O)(=O)C(CSC1=CC=CC=C1[N+](=O)[O-])Cl

InChI

InChI=1S/C14H20ClNO4S2/c1-2-3-4-7-10-22(19,20)14(15)11-21-13-9-6-5-8-12(13)16(17)18/h5-6,8-9,14H,2-4,7,10-11H2,1H3