N-[4,5-dimethyl-3-[[(2S)-2-methylpiperidin-1-ium-1-yl]methyl]thiophen-2-yl]-2-fluoranyl-benzamide

Systemtic Name: N-[4,5-dimethyl-3-[[(2S)-2-methylpiperidin-1-ium-1-yl]methyl]thiophen-2-yl]-2-fluoranyl-benzamide Openeye Name: N-[4,5-dimethyl-3-[[(2S)-2-methylpiperidin-1-ium-1-yl]methyl]-2-thienyl]-2-fluoro-benzamide CAS Name: N-[4,5-dimethyl-3-[[(2S)-2-methyl-1-piperidin-1-iumyl]methyl]-2-thiophenyl]-2-fluorobenzamide IUPAC Name: N-[4,5-dimethyl-3-[[(2S)-2-methylpiperidin-1-ium-1-yl]methyl]thiophen-2-yl]-2-fluorobenzamide Traditional Name: N-[4,5-dimethyl-3-[[(2S)-2-methylpiperidin-1-ium-1-yl]methyl]-2-thienyl]-2-fluoro-benzamide Formula: C20H26FN2OS+ MolecularWeight: 361.496643

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC[NH+]1CC2=C(SC(=C2C)C)NC(=O)C3=CC=CC=C3F

Isomeric SMILES

C[C@H]1CCCC[NH+]1CC2=C(SC(=C2C)C)NC(=O)C3=CC=CC=C3F

InChI

InChI=1S/C20H25FN2OS/c1-13-8-6-7-11-23(13)12-17-14(2)15(3)25-20(17)22-19(24)16-9-4-5-10-18(16)21/h4-5,9-10,13H,6-8,11-12H2,1-3H3,(H,22,24)/p+1/t13-/m0/s1