4-chloranyl-N-(1-cyanononan-5-yl)-2-(phenylcarbonyl)benzenesulfonamide

Systemtic Name: 4-chloranyl-N-(1-cyanononan-5-yl)-2-(phenylcarbonyl)benzenesulfonamide Openeye Name: 2-benzoyl-N-(1-butyl-5-cyano-pentyl)-4-chloro-benzenesulfonamide CAS Name: 2-benzoyl-4-chloro-N-(1-cyanononan-5-yl)benzenesulfonamide IUPAC Name: 2-benzoyl-4-chloro-N-(1-cyanononan-5-yl)benzenesulfonamide Traditional Name: 2-benzoyl-N-(1-butyl-5-cyano-pentyl)-4-chloro-benzenesulfonamide Formula: C23H27ClN2O3S MolecularWeight: 446.99008

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CCCCC#N)NS(=O)(=O)C1=C(C=C(C=C1)Cl)C(=O)C2=CC=CC=C2

Isomeric SMILES

CCCCC(CCCCC#N)NS(=O)(=O)C1=C(C=C(C=C1)Cl)C(=O)C2=CC=CC=C2

InChI

InChI=1S/C23H27ClN2O3S/c1-2-3-12-20(13-8-5-9-16-25)26-30(28,29)22-15-14-19(24)17-21(22)23(27)18-10-6-4-7-11-18/h4,6-7,10-11,14-15,17,20,26H,2-3,5,8-9,12-13H2,1H3