N-[1-[3-(4-chloranylphenoxy)propyl]piperidin-1-ium-4-yl]benzenesulfonamide

Systemtic Name: N-[1-[3-(4-chloranylphenoxy)propyl]piperidin-1-ium-4-yl]benzenesulfonamide Openeye Name: N-[1-[3-(4-chlorophenoxy)propyl]piperidin-1-ium-4-yl]benzenesulfonamide CAS Name: N-[1-[3-(4-chlorophenoxy)propyl]-4-piperidin-1-iumyl]benzenesulfonamide IUPAC Name: N-[1-[3-(4-chlorophenoxy)propyl]piperidin-1-ium-4-yl]benzenesulfonamide Traditional Name: N-[1-[3-(4-chlorophenoxy)propyl]piperidin-1-ium-4-yl]benzenesulfonamide Formula: C20H26ClN2O3S+ MolecularWeight: 409.95004

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1NS(=O)(=O)C2=CC=CC=C2)CCCOC3=CC=C(C=C3)Cl

Isomeric SMILES

C1C[NH+](CCC1NS(=O)(=O)C2=CC=CC=C2)CCCOC3=CC=C(C=C3)Cl

InChI

InChI=1S/C20H25ClN2O3S/c21-17-7-9-19(10-8-17)26-16-4-13-23-14-11-18(12-15-23)22-27(24,25)20-5-2-1-3-6-20/h1-3,5-10,18,22H,4,11-16H2/p+1