N-(2-methyl-5-morpholin-4-ylsulfonyl-phenyl)-2-pyrrolidin-1-ium-1-yl-ethanamide

Systemtic Name: N-(2-methyl-5-morpholin-4-ylsulfonyl-phenyl)-2-pyrrolidin-1-ium-1-yl-ethanamide Openeye Name: N-(2-methyl-5-morpholinosulfonyl-phenyl)-2-pyrrolidin-1-ium-1-yl-acetamide CAS Name: N-[2-methyl-5-(4-morpholinylsulfonyl)phenyl]-2-(1-pyrrolidin-1-iumyl)acetamide IUPAC Name: N-(2-methyl-5-morpholin-4-ylsulfonylphenyl)-2-pyrrolidin-1-ium-1-ylacetamide Traditional Name: N-(2-methyl-5-morpholinosulfonyl-phenyl)-2-pyrrolidin-1-ium-1-yl-acetamide Formula: C17H26N3O4S+ MolecularWeight: 368.47104

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)NC(=O)C[NH+]3CCCC3

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)NC(=O)C[NH+]3CCCC3

InChI

InChI=1S/C17H25N3O4S/c1-14-4-5-15(25(22,23)20-8-10-24-11-9-20)12-16(14)18-17(21)13-19-6-2-3-7-19/h4-5,12H,2-3,6-11,13H2,1H3,(H,18,21)/p+1