N-(3,4-dimethylphenyl)-2,4-dinitro-benzenesulfonamide

Systemtic Name: N-(3,4-dimethylphenyl)-2,4-dinitro-benzenesulfonamide Openeye Name: N-(3,4-dimethylphenyl)-2,4-dinitro-benzenesulfonamide CAS Name: N-(3,4-dimethylphenyl)-2,4-dinitrobenzenesulfonamide IUPAC Name: N-(3,4-dimethylphenyl)-2,4-dinitrobenzenesulfonamide Traditional Name: N-(3,4-dimethylphenyl)-2,4-dinitro-benzenesulfonamide Formula: C14H13N3O6S MolecularWeight: 351.33452

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H13N3O6S/c1-9-3-4-11(7-10(9)2)15-24(22,23)14-6-5-12(16(18)19)8-13(14)17(20)21/h3-8,15H,1-2H3