N'-(3-fluoranyl-4-methyl-phenyl)-N-[[1-(2-methoxyethyl)piperidin-1-ium-4-yl]methyl]ethanediamide

Systemtic Name: N'-(3-fluoranyl-4-methyl-phenyl)-N-[[1-(2-methoxyethyl)piperidin-1-ium-4-yl]methyl]ethanediamide Openeye Name: N'-(3-fluoro-4-methyl-phenyl)-N-[[1-(2-methoxyethyl)piperidin-1-ium-4-yl]methyl]oxamide CAS Name: N'-(3-fluoro-4-methylphenyl)-N-[[1-(2-methoxyethyl)-4-piperidin-1-iumyl]methyl]oxamide IUPAC Name: N'-(3-fluoro-4-methylphenyl)-N-[[1-(2-methoxyethyl)piperidin-1-ium-4-yl]methyl]oxamide Traditional Name: N'-(3-fluoro-4-methyl-phenyl)-N-[[1-(2-methoxyethyl)piperidin-1-ium-4-yl]methyl]oxamide Formula: C18H27FN3O3+ MolecularWeight: 352.423683

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C(=O)NCC2CC[NH+](CC2)CCOC)F

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C(=O)NCC2CC[NH+](CC2)CCOC)F

InChI

InChI=1S/C18H26FN3O3/c1-13-3-4-15(11-16(13)19)21-18(24)17(23)20-12-14-5-7-22(8-6-14)9-10-25-2/h3-4,11,14H,5-10,12H2,1-2H3,(H,20,23)(H,21,24)/p+1