2-methyl-N-(4-methyl-3-nitro-phenyl)-5-nitro-benzenesulfonamide

Systemtic Name: 2-methyl-N-(4-methyl-3-nitro-phenyl)-5-nitro-benzenesulfonamide Openeye Name: 2-methyl-N-(4-methyl-3-nitro-phenyl)-5-nitro-benzenesulfonamide CAS Name: 2-methyl-N-(4-methyl-3-nitrophenyl)-5-nitrobenzenesulfonamide IUPAC Name: 2-methyl-N-(4-methyl-3-nitrophenyl)-5-nitrobenzenesulfonamide Traditional Name: 2-methyl-N-(4-methyl-3-nitro-phenyl)-5-nitro-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=CC(=C2)[N+](=O)[O-])C)[N+](=O)[O-]

Isomeric SMILES

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

InChI

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