2-(2-methyl-4-morpholin-4-ylsulfonyl-phenoxy)-N-(3-morpholin-4-ium-4-ylpropyl)ethanamide

Systemtic Name: 2-(2-methyl-4-morpholin-4-ylsulfonyl-phenoxy)-N-(3-morpholin-4-ium-4-ylpropyl)ethanamide Openeye Name: 2-(2-methyl-4-morpholinosulfonyl-phenoxy)-N-(3-morpholin-4-ium-4-ylpropyl)acetamide CAS Name: 2-[2-methyl-4-(4-morpholinylsulfonyl)phenoxy]-N-[3-(4-morpholin-4-iumyl)propyl]acetamide IUPAC Name: 2-(2-methyl-4-morpholin-4-ylsulfonylphenoxy)-N-(3-morpholin-4-ium-4-ylpropyl)acetamide Traditional Name: 2-(2-methyl-4-morpholinosulfonyl-phenoxy)-N-(3-morpholin-4-ium-4-ylpropyl)acetamide Formula: C20H32N3O6S+ MolecularWeight: 442.54958

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)S(=O)(=O)N2CCOCC2)OCC(=O)NCCC[NH+]3CCOCC3

Isomeric SMILES

CC1=C(C=CC(=C1)S(=O)(=O)N2CCOCC2)OCC(=O)NCCC[NH+]3CCOCC3

InChI

InChI=1S/C20H31N3O6S/c1-17-15-18(30(25,26)23-9-13-28-14-10-23)3-4-19(17)29-16-20(24)21-5-2-6-22-7-11-27-12-8-22/h3-4,15H,2,5-14,16H2,1H3,(H,21,24)/p+1