N-cyclooctyl-4-(pyridin-1-ium-4-ylsulfamoyl)benzamide

Systemtic Name: N-cyclooctyl-4-(pyridin-1-ium-4-ylsulfamoyl)benzamide Openeye Name: N-cyclooctyl-4-(pyridin-1-ium-4-ylsulfamoyl)benzamide CAS Name: N-cyclooctyl-4-(4-pyridin-1-iumylsulfamoyl)benzamide IUPAC Name: N-cyclooctyl-4-(pyridin-1-ium-4-ylsulfamoyl)benzamide Traditional Name: N-cyclooctyl-4-(pyridin-1-ium-4-ylsulfamoyl)benzamide Formula: C20H26N3O3S+ MolecularWeight: 388.50374

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CCC1)NC(=O)C2=CC=C(C=C2)S(=O)(=O)NC3=CC=[NH+]C=C3

Isomeric SMILES

C1CCCC(CCC1)NC(=O)C2=CC=C(C=C2)S(=O)(=O)NC3=CC=[NH+]C=C3

InChI

InChI=1S/C20H25N3O3S/c24-20(22-17-6-4-2-1-3-5-7-17)16-8-10-19(11-9-16)27(25,26)23-18-12-14-21-15-13-18/h8-15,17H,1-7H2,(H,21,23)(H,22,24)/p+1