2-[4-[(4-cyanophenyl)sulfonylamino]piperidin-1-ium-1-yl]-N-phenyl-ethanamide

Systemtic Name: 2-[4-[(4-cyanophenyl)sulfonylamino]piperidin-1-ium-1-yl]-N-phenyl-ethanamide Openeye Name: 2-[4-[(4-cyanophenyl)sulfonylamino]piperidin-1-ium-1-yl]-N-phenyl-acetamide CAS Name: 2-[4-[(4-cyanophenyl)sulfonylamino]-1-piperidin-1-iumyl]-N-phenylacetamide IUPAC Name: 2-[4-[(4-cyanophenyl)sulfonylamino]piperidin-1-ium-1-yl]-N-phenylacetamide Traditional Name: 2-[4-[(4-cyanophenyl)sulfonylamino]piperidin-1-ium-1-yl]-N-phenyl-acetamide Formula: C20H23N4O3S+ MolecularWeight: 399.48662

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1NS(=O)(=O)C2=CC=C(C=C2)C#N)CC(=O)NC3=CC=CC=C3

Isomeric SMILES

C1C[NH+](CCC1NS(=O)(=O)C2=CC=C(C=C2)C#N)CC(=O)NC3=CC=CC=C3

InChI

InChI=1S/C20H22N4O3S/c21-14-16-6-8-19(9-7-16)28(26,27)23-18-10-12-24(13-11-18)15-20(25)22-17-4-2-1-3-5-17/h1-9,18,23H,10-13,15H2,(H,22,25)/p+1