2-[(3S,5R)-3,5-dimethylpiperidin-1-ium-1-yl]-N-(5-morpholin-4-ylsulfonyl-2-propan-2-yloxy-phenyl)ethanamide

Systemtic Name: 2-[(3S,5R)-3,5-dimethylpiperidin-1-ium-1-yl]-N-(5-morpholin-4-ylsulfonyl-2-propan-2-yloxy-phenyl)ethanamide Openeye Name: 2-[(3S,5R)-3,5-dimethylpiperidin-1-ium-1-yl]-N-(2-isopropoxy-5-morpholinosulfonyl-phenyl)acetamide CAS Name: 2-[(3S,5R)-3,5-dimethyl-1-piperidin-1-iumyl]-N-[5-(4-morpholinylsulfonyl)-2-propan-2-yloxyphenyl]acetamide IUPAC Name: 2-[(3S,5R)-3,5-dimethylpiperidin-1-ium-1-yl]-N-(5-morpholin-4-ylsulfonyl-2-propan-2-yloxyphenyl)acetamide Traditional Name: 2-[(3S,5R)-3,5-dimethylpiperidin-1-ium-1-yl]-N-(2-isopropoxy-5-morpholinosulfonyl-phenyl)acetamide Formula: C22H36N3O5S+ MolecularWeight: 454.60334

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(C[NH+](C1)CC(=O)NC2=C(C=CC(=C2)S(=O)(=O)N3CCOCC3)OC(C)C)C

Isomeric SMILES

C[C@@H]1C[C@@H](C[NH+](C1)CC(=O)NC2=C(C=CC(=C2)S(=O)(=O)N3CCOCC3)OC(C)C)C

InChI

InChI=1S/C22H35N3O5S/c1-16(2)30-21-6-5-19(31(27,28)25-7-9-29-10-8-25)12-20(21)23-22(26)15-24-13-17(3)11-18(4)14-24/h5-6,12,16-18H,7-11,13-15H2,1-4H3,(H,23,26)/p+1/t17-,18+