2-chloranyl-1-[1-(4-methylphenyl)sulfonylethylsulfanyl]-3-nitro-benzene

Systemtic Name: 2-chloranyl-1-[1-(4-methylphenyl)sulfonylethylsulfanyl]-3-nitro-benzene Openeye Name: 2-chloro-1-nitro-3-[1-(p-tolylsulfonyl)ethylsulfanyl]benzene CAS Name: 2-chloro-1-[1-(4-methylphenyl)sulfonylethylthio]-3-nitrobenzene IUPAC Name: 2-chloro-1-[1-(4-methylphenyl)sulfonylethylsulfanyl]-3-nitrobenzene Traditional Name: 2-chloro-1-nitro-3-(1-tosylethylthio)benzene Formula: C15H14ClNO4S2 MolecularWeight: 371.85896

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C(C)SC2=CC=CC(=C2Cl)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C(C)SC2=CC=CC(=C2Cl)[N+](=O)[O-]

InChI

InChI=1S/C15H14ClNO4S2/c1-10-6-8-12(9-7-10)23(20,21)11(2)22-14-5-3-4-13(15(14)16)17(18)19/h3-9,11H,1-2H3