4-methyl-N-(2-methylphenyl)-3,5-dinitro-benzenesulfonamide

Systemtic Name: 4-methyl-N-(2-methylphenyl)-3,5-dinitro-benzenesulfonamide Openeye Name: 4-methyl-3,5-dinitro-N-(o-tolyl)benzenesulfonamide CAS Name: 4-methyl-N-(2-methylphenyl)-3,5-dinitrobenzenesulfonamide IUPAC Name: 4-methyl-N-(2-methylphenyl)-3,5-dinitrobenzenesulfonamide Traditional Name: 4-methyl-3,5-dinitro-N-(o-tolyl)benzenesulfonamide Formula: C14H13N3O6S MolecularWeight: 351.33452

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NS(=O)(=O)C2=CC(=C(C(=C2)[N+](=O)[O-])C)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=CC=C1NS(=O)(=O)C2=CC(=C(C(=C2)[N+](=O)[O-])C)[N+](=O)[O-]

InChI

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