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

Systemtic Name: 1-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-N-(3-methoxypropyl)piperidin-1-ium-4-carboxamide Openeye Name: 1-[(2-chloro-6-fluoro-phenyl)methyl]-N-(3-methoxypropyl)piperidin-1-ium-4-carboxamide CAS Name: 1-[(2-chloro-6-fluorophenyl)methyl]-N-(3-methoxypropyl)-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[(2-chloro-6-fluorophenyl)methyl]-N-(3-methoxypropyl)piperidin-1-ium-4-carboxamide Traditional Name: 1-(2-chloro-6-fluoro-benzyl)-N-(3-methoxypropyl)piperidin-1-ium-4-carboxamide Formula: C17H25ClFN2O2+ MolecularWeight: 343.844003

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Descriptors Computed from Structure

Canonical SMILES:

COCCCNC(=O)C1CC[NH+](CC1)CC2=C(C=CC=C2Cl)F

Isomeric SMILES

COCCCNC(=O)C1CC[NH+](CC1)CC2=C(C=CC=C2Cl)F

InChI

InChI=1S/C17H24ClFN2O2/c1-23-11-3-8-20-17(22)13-6-9-21(10-7-13)12-14-15(18)4-2-5-16(14)19/h2,4-5,13H,3,6-12H2,1H3,(H,20,22)/p+1