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

Systemtic Name: N-(3-cyanophenyl)-5-octylsulfonyl-2-oxidanyl-benzamide Openeye Name: N-(3-cyanophenyl)-2-hydroxy-5-octylsulfonyl-benzamide CAS Name: N-(3-cyanophenyl)-2-hydroxy-5-octylsulfonylbenzamide IUPAC Name: N-(3-cyanophenyl)-2-hydroxy-5-octylsulfonylbenzamide Traditional Name: N-(3-cyanophenyl)-2-hydroxy-5-octylsulfonyl-benzamide Formula: C22H26N2O4S MolecularWeight: 414.51784

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H26N2O4S/c1-2-3-4-5-6-7-13-29(27,28)19-11-12-21(25)20(15-19)22(26)24-18-10-8-9-17(14-18)16-23/h8-12,14-15,25H,2-7,13H2,1H3,(H,24,26)