2-(2-chloranyl-4-morpholin-4-ylsulfonyl-phenoxy)-N-(2-morpholin-4-ium-4-ylethyl)ethanamide

Systemtic Name: 2-(2-chloranyl-4-morpholin-4-ylsulfonyl-phenoxy)-N-(2-morpholin-4-ium-4-ylethyl)ethanamide Openeye Name: 2-(2-chloro-4-morpholinosulfonyl-phenoxy)-N-(2-morpholin-4-ium-4-ylethyl)acetamide CAS Name: 2-[2-chloro-4-(4-morpholinylsulfonyl)phenoxy]-N-[2-(4-morpholin-4-iumyl)ethyl]acetamide IUPAC Name: 2-(2-chloro-4-morpholin-4-ylsulfonylphenoxy)-N-(2-morpholin-4-ium-4-ylethyl)acetamide Traditional Name: 2-(2-chloro-4-morpholinosulfonyl-phenoxy)-N-(2-morpholin-4-ium-4-ylethyl)acetamide Formula: C18H27ClN3O6S+ MolecularWeight: 448.94148

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCNC(=O)COC2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)Cl

Isomeric SMILES

C1COCC[NH+]1CCNC(=O)COC2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)Cl

InChI

InChI=1S/C18H26ClN3O6S/c19-16-13-15(29(24,25)22-7-11-27-12-8-22)1-2-17(16)28-14-18(23)20-3-4-21-5-9-26-10-6-21/h1-2,13H,3-12,14H2,(H,20,23)/p+1