2-[(2S)-2-methylpiperidin-1-ium-1-yl]-N-(2-methyl-5-piperidin-1-ylsulfonyl-phenyl)ethanamide

Systemtic Name: 2-[(2S)-2-methylpiperidin-1-ium-1-yl]-N-(2-methyl-5-piperidin-1-ylsulfonyl-phenyl)ethanamide Openeye Name: 2-[(2S)-2-methylpiperidin-1-ium-1-yl]-N-[2-methyl-5-(1-piperidylsulfonyl)phenyl]acetamide CAS Name: 2-[(2S)-2-methyl-1-piperidin-1-iumyl]-N-[2-methyl-5-(1-piperidinylsulfonyl)phenyl]acetamide IUPAC Name: 2-[(2S)-2-methylpiperidin-1-ium-1-yl]-N-(2-methyl-5-piperidin-1-ylsulfonylphenyl)acetamide Traditional Name: 2-[(2S)-2-methylpiperidin-1-ium-1-yl]-N-(2-methyl-5-piperidinosulfonyl-phenyl)acetamide Formula: C20H32N3O3S+ MolecularWeight: 394.55138

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC[NH+]1CC(=O)NC2=C(C=CC(=C2)S(=O)(=O)N3CCCCC3)C

Isomeric SMILES

C[C@H]1CCCC[NH+]1CC(=O)NC2=C(C=CC(=C2)S(=O)(=O)N3CCCCC3)C

InChI

InChI=1S/C20H31N3O3S/c1-16-9-10-18(27(25,26)23-12-5-3-6-13-23)14-19(16)21-20(24)15-22-11-7-4-8-17(22)2/h9-10,14,17H,3-8,11-13,15H2,1-2H3,(H,21,24)/p+1/t17-/m0/s1