N-[2-(hexanoylsulfamoyl)phenyl]-4-oct-1-ynyl-benzamide

Systemtic Name: N-[2-(hexanoylsulfamoyl)phenyl]-4-oct-1-ynyl-benzamide Openeye Name: N-[2-(hexanoylsulfamoyl)phenyl]-4-oct-1-ynyl-benzamide CAS Name: 4-oct-1-ynyl-N-[2-(1-oxohexylsulfamoyl)phenyl]benzamide IUPAC Name: N-[2-(hexanoylsulfamoyl)phenyl]-4-oct-1-ynylbenzamide Traditional Name: N-[2-(caproylsulfamoyl)phenyl]-4-oct-1-ynyl-benzamide Formula: C27H34N2O4S MolecularWeight: 482.63486

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC#CC1=CC=C(C=C1)C(=O)NC2=CC=CC=C2S(=O)(=O)NC(=O)CCCCC

Isomeric SMILES

CCCCCCC#CC1=CC=C(C=C1)C(=O)NC2=CC=CC=C2S(=O)(=O)NC(=O)CCCCC

InChI

InChI=1S/C27H34N2O4S/c1-3-5-7-8-9-11-14-22-18-20-23(21-19-22)27(31)28-24-15-12-13-16-25(24)34(32,33)29-26(30)17-10-6-4-2/h12-13,15-16,18-21H,3-10,17H2,1-2H3,(H,28,31)(H,29,30)