3-chloranyl-N,4-dimethyl-5-nitro-N-[1-(4-sulfamoylphenyl)ethyl]benzenesulfonamide

Systemtic Name: 3-chloranyl-N,4-dimethyl-5-nitro-N-[1-(4-sulfamoylphenyl)ethyl]benzenesulfonamide Openeye Name: 3-chloro-N,4-dimethyl-5-nitro-N-[1-(4-sulfamoylphenyl)ethyl]benzenesulfonamide CAS Name: 3-chloro-N,4-dimethyl-5-nitro-N-[1-(4-sulfamoylphenyl)ethyl]benzenesulfonamide IUPAC Name: 3-chloro-N,4-dimethyl-5-nitro-N-[1-(4-sulfamoylphenyl)ethyl]benzenesulfonamide Traditional Name: 3-chloro-N,4-dimethyl-5-nitro-N-[1-(4-sulfamoylphenyl)ethyl]benzenesulfonamide Formula: C16H18ClN3O6S2 MolecularWeight: 447.91362

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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)N)Cl

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)N)Cl

InChI

InChI=1S/C16H18ClN3O6S2/c1-10-15(17)8-14(9-16(10)20(21)22)28(25,26)19(3)11(2)12-4-6-13(7-5-12)27(18,23)24/h4-9,11H,1-3H3,(H2,18,23,24)