N-(2,6-dimethylphenyl)-2-[2-(4-phenethylpiperidin-1-ium-1-yl)ethanoylamino]ethanamide

Systemtic Name: N-(2,6-dimethylphenyl)-2-[2-(4-phenethylpiperidin-1-ium-1-yl)ethanoylamino]ethanamide Openeye Name: N-(2,6-dimethylphenyl)-2-[[2-(4-phenethylpiperidin-1-ium-1-yl)acetyl]amino]acetamide CAS Name: N-(2,6-dimethylphenyl)-2-[[1-oxo-2-(4-phenethyl-1-piperidin-1-iumyl)ethyl]amino]acetamide IUPAC Name: N-(2,6-dimethylphenyl)-2-[[2-(4-phenethylpiperidin-1-ium-1-yl)acetyl]amino]acetamide Traditional Name: N-(2,6-dimethylphenyl)-2-[[2-(4-phenethylpiperidin-1-ium-1-yl)acetyl]amino]acetamide Formula: C25H34N3O2+ MolecularWeight: 408.55636

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=O)CNC(=O)C[NH+]2CCC(CC2)CCC3=CC=CC=C3

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=O)CNC(=O)C[NH+]2CCC(CC2)CCC3=CC=CC=C3

InChI

InChI=1S/C25H33N3O2/c1-19-7-6-8-20(2)25(19)27-23(29)17-26-24(30)18-28-15-13-22(14-16-28)12-11-21-9-4-3-5-10-21/h3-10,22H,11-18H2,1-2H3,(H,26,30)(H,27,29)/p+1