2-[4-[(3,4-dimethoxyphenyl)sulfonylamino]piperidin-1-ium-1-yl]-N-phenyl-ethanamide

Systemtic Name: 2-[4-[(3,4-dimethoxyphenyl)sulfonylamino]piperidin-1-ium-1-yl]-N-phenyl-ethanamide Openeye Name: 2-[4-[(3,4-dimethoxyphenyl)sulfonylamino]piperidin-1-ium-1-yl]-N-phenyl-acetamide CAS Name: 2-[4-[(3,4-dimethoxyphenyl)sulfonylamino]-1-piperidin-1-iumyl]-N-phenylacetamide IUPAC Name: 2-[4-[(3,4-dimethoxyphenyl)sulfonylamino]piperidin-1-ium-1-yl]-N-phenylacetamide Traditional Name: 2-[4-[(3,4-dimethoxyphenyl)sulfonylamino]piperidin-1-ium-1-yl]-N-phenyl-acetamide Formula: C21H28N3O5S+ MolecularWeight: 434.52912

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)NC2CC[NH+](CC2)CC(=O)NC3=CC=CC=C3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)NC2CC[NH+](CC2)CC(=O)NC3=CC=CC=C3)OC

InChI

InChI=1S/C21H27N3O5S/c1-28-19-9-8-18(14-20(19)29-2)30(26,27)23-17-10-12-24(13-11-17)15-21(25)22-16-6-4-3-5-7-16/h3-9,14,17,23H,10-13,15H2,1-2H3,(H,22,25)/p+1