3-[(2-fluorophenyl)methylsulfonyl]-N-(3-piperidin-1-ium-1-ylpropyl)propanamide

Systemtic Name: 3-[(2-fluorophenyl)methylsulfonyl]-N-(3-piperidin-1-ium-1-ylpropyl)propanamide Openeye Name: 3-[(2-fluorophenyl)methylsulfonyl]-N-(3-piperidin-1-ium-1-ylpropyl)propanamide CAS Name: 3-[(2-fluorophenyl)methylsulfonyl]-N-[3-(1-piperidin-1-iumyl)propyl]propanamide IUPAC Name: 3-[(2-fluorophenyl)methylsulfonyl]-N-(3-piperidin-1-ium-1-ylpropyl)propanamide Traditional Name: 3-(2-fluorobenzyl)sulfonyl-N-(3-piperidin-1-ium-1-ylpropyl)propionamide Formula: C18H28FN2O3S+ MolecularWeight: 371.489923

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CCCNC(=O)CCS(=O)(=O)CC2=CC=CC=C2F

Isomeric SMILES

C1CC[NH+](CC1)CCCNC(=O)CCS(=O)(=O)CC2=CC=CC=C2F

InChI

InChI=1S/C18H27FN2O3S/c19-17-8-3-2-7-16(17)15-25(23,24)14-9-18(22)20-10-6-13-21-11-4-1-5-12-21/h2-3,7-8H,1,4-6,9-15H2,(H,20,22)/p+1