3-ethanoyl-N-methyl-N-[[(2S)-1-methylpiperidin-1-ium-2-yl]methyl]benzamide

Systemtic Name: 3-ethanoyl-N-methyl-N-[[(2S)-1-methylpiperidin-1-ium-2-yl]methyl]benzamide Openeye Name: 3-acetyl-N-methyl-N-[[(2S)-1-methylpiperidin-1-ium-2-yl]methyl]benzamide CAS Name: 3-acetyl-N-methyl-N-[[(2S)-1-methyl-2-piperidin-1-iumyl]methyl]benzamide IUPAC Name: 3-acetyl-N-methyl-N-[[(2S)-1-methylpiperidin-1-ium-2-yl]methyl]benzamide Traditional Name: 3-acetyl-N-methyl-N-[[(2S)-1-methylpiperidin-1-ium-2-yl]methyl]benzamide Formula: C17H25N2O2+ MolecularWeight: 289.3926

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)C(=O)N(C)CC2CCCC[NH+]2C

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)C(=O)N(C)C[C@@H]2CCCC[NH+]2C

InChI

InChI=1S/C17H24N2O2/c1-13(20)14-7-6-8-15(11-14)17(21)19(3)12-16-9-4-5-10-18(16)2/h6-8,11,16H,4-5,9-10,12H2,1-3H3/p+1/t16-/m0/s1