N-(2,3-dimethylphenyl)-2-[2-[(2S)-2-methylpiperidin-1-ium-1-yl]ethanoylamino]ethanamide

Systemtic Name: N-(2,3-dimethylphenyl)-2-[2-[(2S)-2-methylpiperidin-1-ium-1-yl]ethanoylamino]ethanamide Openeye Name: N-(2,3-dimethylphenyl)-2-[[2-[(2S)-2-methylpiperidin-1-ium-1-yl]acetyl]amino]acetamide CAS Name: N-(2,3-dimethylphenyl)-2-[[2-[(2S)-2-methyl-1-piperidin-1-iumyl]-1-oxoethyl]amino]acetamide IUPAC Name: N-(2,3-dimethylphenyl)-2-[[2-[(2S)-2-methylpiperidin-1-ium-1-yl]acetyl]amino]acetamide Traditional Name: N-(2,3-dimethylphenyl)-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:

CC1CCCC[NH+]1CC(=O)NCC(=O)NC2=CC=CC(=C2C)C

Isomeric SMILES

C[C@H]1CCCC[NH+]1CC(=O)NCC(=O)NC2=CC=CC(=C2C)C

InChI

InChI=1S/C18H27N3O2/c1-13-7-6-9-16(15(13)3)20-17(22)11-19-18(23)12-21-10-5-4-8-14(21)2/h6-7,9,14H,4-5,8,10-12H2,1-3H3,(H,19,23)(H,20,22)/p+1/t14-/m0/s1