2-methyl-5-nitro-benzenesulfonyl chloride

Systemtic Name: 2-methyl-5-nitro-benzenesulfonyl chloride Openeye Name: 2-methyl-5-nitro-benzenesulfonyl chloride CAS Name: 2-methyl-5-nitrobenzenesulfonyl chloride IUPAC Name: 2-methyl-5-nitrobenzenesulfonyl chloride Traditional Name: 2-methyl-5-nitro-benzenesulfonyl chloride Formula: C7H6ClNO4S MolecularWeight: 235.64484

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)Cl

InChI

InChI=1S/C7H6ClNO4S/c1-5-2-3-6(9(10)11)4-7(5)14(8,12)13/h2-4H,1H3