N-(3-cyanophenyl)-5-heptylsulfonyl-2-oxidanyl-benzamide

Systemtic Name: N-(3-cyanophenyl)-5-heptylsulfonyl-2-oxidanyl-benzamide Openeye Name: N-(3-cyanophenyl)-5-heptylsulfonyl-2-hydroxy-benzamide CAS Name: N-(3-cyanophenyl)-5-heptylsulfonyl-2-hydroxybenzamide IUPAC Name: N-(3-cyanophenyl)-5-heptylsulfonyl-2-hydroxybenzamide Traditional Name: N-(3-cyanophenyl)-5-heptylsulfonyl-2-hydroxy-benzamide Formula: C21H24N2O4S MolecularWeight: 400.49126

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCS(=O)(=O)C1=CC(=C(C=C1)O)C(=O)NC2=CC=CC(=C2)C#N

Isomeric SMILES

CCCCCCCS(=O)(=O)C1=CC(=C(C=C1)O)C(=O)NC2=CC=CC(=C2)C#N

InChI

InChI=1S/C21H24N2O4S/c1-2-3-4-5-6-12-28(26,27)18-10-11-20(24)19(14-18)21(25)23-17-9-7-8-16(13-17)15-22/h7-11,13-14,24H,2-6,12H2,1H3,(H,23,25)