1-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-N-(3-imidazol-1-ylpropyl)piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-N-(3-imidazol-1-ylpropyl)piperidin-1-ium-4-carboxamide Openeye Name: 1-[(2-chloro-6-fluoro-phenyl)methyl]-N-(3-imidazol-1-ylpropyl)piperidin-1-ium-4-carboxamide CAS Name: 1-[(2-chloro-6-fluorophenyl)methyl]-N-[3-(1-imidazolyl)propyl]-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[(2-chloro-6-fluorophenyl)methyl]-N-(3-imidazol-1-ylpropyl)piperidin-1-ium-4-carboxamide Traditional Name: 1-(2-chloro-6-fluoro-benzyl)-N-(3-imidazol-1-ylpropyl)piperidin-1-ium-4-carboxamide Formula: C19H25ClFN4O+ MolecularWeight: 379.879403

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1C(=O)NCCCN2C=CN=C2)CC3=C(C=CC=C3Cl)F

Isomeric SMILES

C1C[NH+](CCC1C(=O)NCCCN2C=CN=C2)CC3=C(C=CC=C3Cl)F

InChI

InChI=1S/C19H24ClFN4O/c20-17-3-1-4-18(21)16(17)13-24-10-5-15(6-11-24)19(26)23-7-2-9-25-12-8-22-14-25/h1,3-4,8,12,14-15H,2,5-7,9-11,13H2,(H,23,26)/p+1