1-[(4-fluorophenyl)methyl]-N-(3-imidazol-1-ylpropyl)piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[(4-fluorophenyl)methyl]-N-(3-imidazol-1-ylpropyl)piperidin-1-ium-4-carboxamide Openeye Name: 1-[(4-fluorophenyl)methyl]-N-(3-imidazol-1-ylpropyl)piperidin-1-ium-4-carboxamide CAS Name: 1-[(4-fluorophenyl)methyl]-N-[3-(1-imidazolyl)propyl]-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[(4-fluorophenyl)methyl]-N-(3-imidazol-1-ylpropyl)piperidin-1-ium-4-carboxamide Traditional Name: 1-(4-fluorobenzyl)-N-(3-imidazol-1-ylpropyl)piperidin-1-ium-4-carboxamide Formula: C19H26FN4O+ MolecularWeight: 345.434343

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1C(=O)NCCCN2C=CN=C2)CC3=CC=C(C=C3)F

Isomeric SMILES

C1C[NH+](CCC1C(=O)NCCCN2C=CN=C2)CC3=CC=C(C=C3)F

InChI

InChI=1S/C19H25FN4O/c20-18-4-2-16(3-5-18)14-23-11-6-17(7-12-23)19(25)22-8-1-10-24-13-9-21-15-24/h2-5,9,13,15,17H,1,6-8,10-12,14H2,(H,22,25)/p+1