1-(4-fluorophenyl)sulfonyl-N-(1-propylpiperidin-1-ium-4-yl)piperidine-4-carboxamide

Systemtic Name: 1-(4-fluorophenyl)sulfonyl-N-(1-propylpiperidin-1-ium-4-yl)piperidine-4-carboxamide Openeye Name: 1-(4-fluorophenyl)sulfonyl-N-(1-propylpiperidin-1-ium-4-yl)piperidine-4-carboxamide CAS Name: 1-(4-fluorophenyl)sulfonyl-N-(1-propyl-4-piperidin-1-iumyl)-4-piperidinecarboxamide IUPAC Name: 1-(4-fluorophenyl)sulfonyl-N-(1-propylpiperidin-1-ium-4-yl)piperidine-4-carboxamide Traditional Name: 1-(4-fluorophenyl)sulfonyl-N-(1-propylpiperidin-1-ium-4-yl)isonipecotamide Formula: C20H31FN3O3S+ MolecularWeight: 412.541843

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+]1CCC(CC1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)F

Isomeric SMILES

CCC[NH+]1CCC(CC1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C20H30FN3O3S/c1-2-11-23-12-9-18(10-13-23)22-20(25)16-7-14-24(15-8-16)28(26,27)19-5-3-17(21)4-6-19/h3-6,16,18H,2,7-15H2,1H3,(H,22,25)/p+1