N-(4,5-dimethyl-2-nitro-phenyl)benzenesulfonamide

Systemtic Name: N-(4,5-dimethyl-2-nitro-phenyl)benzenesulfonamide Openeye Name: N-(4,5-dimethyl-2-nitro-phenyl)benzenesulfonamide CAS Name: N-(4,5-dimethyl-2-nitrophenyl)benzenesulfonamide IUPAC Name: N-(4,5-dimethyl-2-nitrophenyl)benzenesulfonamide Traditional Name: N-(4,5-dimethyl-2-nitro-phenyl)benzenesulfonamide Formula: C14H14N2O4S MolecularWeight: 306.33696

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C)[N+](=O)[O-])NS(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

CC1=CC(=C(C=C1C)[N+](=O)[O-])NS(=O)(=O)C2=CC=CC=C2

InChI

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