N-(2,6-dimethyl-3-nitro-phenyl)benzenesulfonamide

Systemtic Name: N-(2,6-dimethyl-3-nitro-phenyl)benzenesulfonamide Openeye Name: N-(2,6-dimethyl-3-nitro-phenyl)benzenesulfonamide CAS Name: N-(2,6-dimethyl-3-nitrophenyl)benzenesulfonamide IUPAC Name: N-(2,6-dimethyl-3-nitrophenyl)benzenesulfonamide Traditional Name: N-(2,6-dimethyl-3-nitro-phenyl)benzenesulfonamide Formula: C14H14N2O4S MolecularWeight: 306.33696

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H14N2O4S/c1-10-8-9-13(16(17)18)11(2)14(10)15-21(19,20)12-6-4-3-5-7-12/h3-9,15H,1-2H3