N-(4-methyl-3-morpholin-4-ylsulfonyl-phenyl)-2-(4-oxidanylpiperidin-1-ium-1-yl)ethanamide

Systemtic Name: N-(4-methyl-3-morpholin-4-ylsulfonyl-phenyl)-2-(4-oxidanylpiperidin-1-ium-1-yl)ethanamide Openeye Name: 2-(4-hydroxypiperidin-1-ium-1-yl)-N-(4-methyl-3-morpholinosulfonyl-phenyl)acetamide CAS Name: 2-(4-hydroxy-1-piperidin-1-iumyl)-N-[4-methyl-3-(4-morpholinylsulfonyl)phenyl]acetamide IUPAC Name: 2-(4-hydroxypiperidin-1-ium-1-yl)-N-(4-methyl-3-morpholin-4-ylsulfonylphenyl)acetamide Traditional Name: 2-(4-hydroxypiperidin-1-ium-1-yl)-N-(4-methyl-3-morpholinosulfonyl-phenyl)acetamide Formula: C18H28N3O5S+ MolecularWeight: 398.49702

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C[NH+]2CCC(CC2)O)S(=O)(=O)N3CCOCC3

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C[NH+]2CCC(CC2)O)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C18H27N3O5S/c1-14-2-3-15(19-18(23)13-20-6-4-16(22)5-7-20)12-17(14)27(24,25)21-8-10-26-11-9-21/h2-3,12,16,22H,4-11,13H2,1H3,(H,19,23)/p+1