N,2-dimethyl-N-[1-(4-methylsulfonylphenyl)ethyl]-5-nitro-benzenesulfonamide

Systemtic Name: N,2-dimethyl-N-[1-(4-methylsulfonylphenyl)ethyl]-5-nitro-benzenesulfonamide Openeye Name: N,2-dimethyl-N-[1-(4-methylsulfonylphenyl)ethyl]-5-nitro-benzenesulfonamide CAS Name: N,2-dimethyl-N-[1-(4-methylsulfonylphenyl)ethyl]-5-nitrobenzenesulfonamide IUPAC Name: N,2-dimethyl-N-[1-(4-methylsulfonylphenyl)ethyl]-5-nitrobenzenesulfonamide Traditional Name: N-[1-(4-mesylphenyl)ethyl]-N,2-dimethyl-5-nitro-benzenesulfonamide Formula: C17H20N2O6S2 MolecularWeight: 412.4805

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)N(C)C(C)C2=CC=C(C=C2)S(=O)(=O)C

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)N(C)C(C)C2=CC=C(C=C2)S(=O)(=O)C

InChI

InChI=1S/C17H20N2O6S2/c1-12-5-8-15(19(20)21)11-17(12)27(24,25)18(3)13(2)14-6-9-16(10-7-14)26(4,22)23/h5-11,13H,1-4H3