1-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-N-[2-(cyclohexen-1-yl)ethyl]piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-N-[2-(cyclohexen-1-yl)ethyl]piperidin-1-ium-4-carboxamide Openeye Name: 1-[(2-chloro-6-fluoro-phenyl)methyl]-N-[2-(cyclohexen-1-yl)ethyl]piperidin-1-ium-4-carboxamide CAS Name: 1-[(2-chloro-6-fluorophenyl)methyl]-N-[2-(1-cyclohexenyl)ethyl]-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[(2-chloro-6-fluorophenyl)methyl]-N-[2-(cyclohexen-1-yl)ethyl]piperidin-1-ium-4-carboxamide Traditional Name: 1-(2-chloro-6-fluoro-benzyl)-N-[2-(cyclohexen-1-yl)ethyl]piperidin-1-ium-4-carboxamide Formula: C21H29ClFN2O+ MolecularWeight: 379.919163

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=CC1)CCNC(=O)C2CC[NH+](CC2)CC3=C(C=CC=C3Cl)F

Isomeric SMILES

C1CCC(=CC1)CCNC(=O)C2CC[NH+](CC2)CC3=C(C=CC=C3Cl)F

InChI

InChI=1S/C21H28ClFN2O/c22-19-7-4-8-20(23)18(19)15-25-13-10-17(11-14-25)21(26)24-12-9-16-5-2-1-3-6-16/h4-5,7-8,17H,1-3,6,9-15H2,(H,24,26)/p+1