1-[[2-[(4-fluoranylphenoxy)methyl]-1,3-thiazol-4-yl]methyl]piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[[2-[(4-fluoranylphenoxy)methyl]-1,3-thiazol-4-yl]methyl]piperidin-1-ium-4-carboxamide Openeye Name: 1-[[2-[(4-fluorophenoxy)methyl]thiazol-4-yl]methyl]piperidin-1-ium-4-carboxamide CAS Name: 1-[[2-[(4-fluorophenoxy)methyl]-4-thiazolyl]methyl]-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[[2-[(4-fluorophenoxy)methyl]-1,3-thiazol-4-yl]methyl]piperidin-1-ium-4-carboxamide Traditional Name: 1-[[2-[(4-fluorophenoxy)methyl]thiazol-4-yl]methyl]piperidin-1-ium-4-carboxamide Formula: C17H21FN3O2S+ MolecularWeight: 350.430943

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1C(=O)N)CC2=CSC(=N2)COC3=CC=C(C=C3)F

Isomeric SMILES

C1C[NH+](CCC1C(=O)N)CC2=CSC(=N2)COC3=CC=C(C=C3)F

InChI

InChI=1S/C17H20FN3O2S/c18-13-1-3-15(4-2-13)23-10-16-20-14(11-24-16)9-21-7-5-12(6-8-21)17(19)22/h1-4,11-12H,5-10H2,(H2,19,22)/p+1