N-(5-azanyl-2-fluoranyl-phenyl)-2-[(3S)-3-methylpiperidin-1-ium-1-yl]ethanamide

Systemtic Name: N-(5-azanyl-2-fluoranyl-phenyl)-2-[(3S)-3-methylpiperidin-1-ium-1-yl]ethanamide Openeye Name: N-(5-amino-2-fluoro-phenyl)-2-[(3S)-3-methylpiperidin-1-ium-1-yl]acetamide CAS Name: N-(5-amino-2-fluorophenyl)-2-[(3S)-3-methyl-1-piperidin-1-iumyl]acetamide IUPAC Name: N-(5-amino-2-fluorophenyl)-2-[(3S)-3-methylpiperidin-1-ium-1-yl]acetamide Traditional Name: N-(5-amino-2-fluoro-phenyl)-2-[(3S)-3-methylpiperidin-1-ium-1-yl]acetamide Formula: C14H21FN3O+ MolecularWeight: 266.334443

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC[NH+](C1)CC(=O)NC2=C(C=CC(=C2)N)F

Isomeric SMILES

C[C@H]1CCC[NH+](C1)CC(=O)NC2=C(C=CC(=C2)N)F

InChI

InChI=1S/C14H20FN3O/c1-10-3-2-6-18(8-10)9-14(19)17-13-7-11(16)4-5-12(13)15/h4-5,7,10H,2-3,6,8-9,16H2,1H3,(H,17,19)/p+1/t10-/m0/s1