N-(2-ethylphenyl)-2-[2-[(2S)-2-methylpiperidin-1-ium-1-yl]ethanoylamino]ethanamide

Systemtic Name: N-(2-ethylphenyl)-2-[2-[(2S)-2-methylpiperidin-1-ium-1-yl]ethanoylamino]ethanamide Openeye Name: N-(2-ethylphenyl)-2-[[2-[(2S)-2-methylpiperidin-1-ium-1-yl]acetyl]amino]acetamide CAS Name: N-(2-ethylphenyl)-2-[[2-[(2S)-2-methyl-1-piperidin-1-iumyl]-1-oxoethyl]amino]acetamide IUPAC Name: N-(2-ethylphenyl)-2-[[2-[(2S)-2-methylpiperidin-1-ium-1-yl]acetyl]amino]acetamide Traditional Name: N-(2-ethylphenyl)-2-[[2-[(2S)-2-methylpiperidin-1-ium-1-yl]acetyl]amino]acetamide Formula: C18H28N3O2+ MolecularWeight: 318.43382

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=O)CNC(=O)C[NH+]2CCCCC2C

Isomeric SMILES

CCC1=CC=CC=C1NC(=O)CNC(=O)C[NH+]2CCCC[C@@H]2C

InChI

InChI=1S/C18H27N3O2/c1-3-15-9-4-5-10-16(15)20-17(22)12-19-18(23)13-21-11-7-6-8-14(21)2/h4-5,9-10,14H,3,6-8,11-13H2,1-2H3,(H,19,23)(H,20,22)/p+1/t14-/m0/s1