2-chloranyl-4-cyano-5-isocyano-N-(2,3,5-trimethyl-4-oxidanyl-phenyl)benzenesulfonamide

Systemtic Name: 2-chloranyl-4-cyano-5-isocyano-N-(2,3,5-trimethyl-4-oxidanyl-phenyl)benzenesulfonamide Openeye Name: 2-chloro-4-cyano-N-(4-hydroxy-2,3,5-trimethyl-phenyl)-5-isocyano-benzenesulfonamide CAS Name: 2-chloro-4-cyano-N-(4-hydroxy-2,3,5-trimethylphenyl)-5-isocyanobenzenesulfonamide IUPAC Name: 2-chloro-4-cyano-N-(4-hydroxy-2,3,5-trimethylphenyl)-5-isocyanobenzenesulfonamide Traditional Name: 2-chloro-4-cyano-N-(4-hydroxy-2,3,5-trimethyl-phenyl)-5-isocyano-benzenesulfonamide Formula: C17H14ClN3O3S MolecularWeight: 375.82936

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1O)C)C)NS(=O)(=O)C2=C(C=C(C(=C2)[N+]#[C-])C#N)Cl

Isomeric SMILES

CC1=CC(=C(C(=C1O)C)C)NS(=O)(=O)C2=C(C=C(C(=C2)[N+]#[C-])C#N)Cl

InChI

InChI=1S/C17H14ClN3O3S/c1-9-5-14(10(2)11(3)17(9)22)21-25(23,24)16-7-15(20-4)12(8-19)6-13(16)18/h5-7,21-22H,1-3H3