2-[(3R)-3-methylpiperidin-1-ium-1-yl]-N-(4-methyl-3-piperidin-1-ylsulfonyl-phenyl)ethanamide

Systemtic Name: 2-[(3R)-3-methylpiperidin-1-ium-1-yl]-N-(4-methyl-3-piperidin-1-ylsulfonyl-phenyl)ethanamide Openeye Name: 2-[(3R)-3-methylpiperidin-1-ium-1-yl]-N-[4-methyl-3-(1-piperidylsulfonyl)phenyl]acetamide CAS Name: 2-[(3R)-3-methyl-1-piperidin-1-iumyl]-N-[4-methyl-3-(1-piperidinylsulfonyl)phenyl]acetamide IUPAC Name: 2-[(3R)-3-methylpiperidin-1-ium-1-yl]-N-(4-methyl-3-piperidin-1-ylsulfonylphenyl)acetamide Traditional Name: 2-[(3R)-3-methylpiperidin-1-ium-1-yl]-N-(4-methyl-3-piperidinosulfonyl-phenyl)acetamide Formula: C20H32N3O3S+ MolecularWeight: 394.55138

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC[NH+](C1)CC(=O)NC2=CC(=C(C=C2)C)S(=O)(=O)N3CCCCC3

Isomeric SMILES

C[C@@H]1CCC[NH+](C1)CC(=O)NC2=CC(=C(C=C2)C)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C20H31N3O3S/c1-16-7-6-10-22(14-16)15-20(24)21-18-9-8-17(2)19(13-18)27(25,26)23-11-4-3-5-12-23/h8-9,13,16H,3-7,10-12,14-15H2,1-2H3,(H,21,24)/p+1/t16-/m1/s1