2-[4-(1,3-benzothiazol-2-yl)piperidin-1-ium-1-yl]-N-[(3-fluorophenyl)methyl]-N-methyl-ethanamide

Systemtic Name: 2-[4-(1,3-benzothiazol-2-yl)piperidin-1-ium-1-yl]-N-[(3-fluorophenyl)methyl]-N-methyl-ethanamide Openeye Name: 2-[4-(1,3-benzothiazol-2-yl)piperidin-1-ium-1-yl]-N-[(3-fluorophenyl)methyl]-N-methyl-acetamide CAS Name: 2-[4-(1,3-benzothiazol-2-yl)-1-piperidin-1-iumyl]-N-[(3-fluorophenyl)methyl]-N-methylacetamide IUPAC Name: 2-[4-(1,3-benzothiazol-2-yl)piperidin-1-ium-1-yl]-N-[(3-fluorophenyl)methyl]-N-methylacetamide Traditional Name: 2-[4-(1,3-benzothiazol-2-yl)piperidin-1-ium-1-yl]-N-(3-fluorobenzyl)-N-methyl-acetamide Formula: C22H25FN3OS+ MolecularWeight: 398.516803

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC(=CC=C1)F)C(=O)C[NH+]2CCC(CC2)C3=NC4=CC=CC=C4S3

Isomeric SMILES

CN(CC1=CC(=CC=C1)F)C(=O)C[NH+]2CCC(CC2)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C22H24FN3OS/c1-25(14-16-5-4-6-18(23)13-16)21(27)15-26-11-9-17(10-12-26)22-24-19-7-2-3-8-20(19)28-22/h2-8,13,17H,9-12,14-15H2,1H3/p+1