(2S)-1-[2-[(2-fluorophenyl)methylamino]-2-oxidanylidene-ethyl]piperidin-1-ium-2-carboxamide

Systemtic Name: (2S)-1-[2-[(2-fluorophenyl)methylamino]-2-oxidanylidene-ethyl]piperidin-1-ium-2-carboxamide Openeye Name: (2S)-1-[2-[(2-fluorophenyl)methylamino]-2-oxo-ethyl]piperidin-1-ium-2-carboxamide CAS Name: (2S)-1-[2-[(2-fluorophenyl)methylamino]-2-oxoethyl]-2-piperidin-1-iumcarboxamide IUPAC Name: (2S)-1-[2-[(2-fluorophenyl)methylamino]-2-oxoethyl]piperidin-1-ium-2-carboxamide Traditional Name: (2S)-1-[2-[(2-fluorobenzyl)amino]-2-keto-ethyl]piperidin-1-ium-2-carboxamide Formula: C15H21FN3O2+ MolecularWeight: 294.344543

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C(C1)C(=O)N)CC(=O)NCC2=CC=CC=C2F

Isomeric SMILES

C1CC[NH+]([C@@H](C1)C(=O)N)CC(=O)NCC2=CC=CC=C2F

InChI

InChI=1S/C15H20FN3O2/c16-12-6-2-1-5-11(12)9-18-14(20)10-19-8-4-3-7-13(19)15(17)21/h1-2,5-6,13H,3-4,7-10H2,(H2,17,21)(H,18,20)/p+1/t13-/m0/s1