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

Systemtic Name: N-(5-morpholin-4-ylsulfonyl-2-propan-2-yloxy-phenyl)-2-pyrrolidin-1-ium-1-yl-ethanamide Openeye Name: N-(2-isopropoxy-5-morpholinosulfonyl-phenyl)-2-pyrrolidin-1-ium-1-yl-acetamide CAS Name: N-[5-(4-morpholinylsulfonyl)-2-propan-2-yloxyphenyl]-2-(1-pyrrolidin-1-iumyl)acetamide IUPAC Name: N-(5-morpholin-4-ylsulfonyl-2-propan-2-yloxyphenyl)-2-pyrrolidin-1-ium-1-ylacetamide Traditional Name: N-(2-isopropoxy-5-morpholinosulfonyl-phenyl)-2-pyrrolidin-1-ium-1-yl-acetamide Formula: C19H30N3O5S+ MolecularWeight: 412.5236

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)NC(=O)C[NH+]3CCCC3

Isomeric SMILES

CC(C)OC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)NC(=O)C[NH+]3CCCC3

InChI

InChI=1S/C19H29N3O5S/c1-15(2)27-18-6-5-16(28(24,25)22-9-11-26-12-10-22)13-17(18)20-19(23)14-21-7-3-4-8-21/h5-6,13,15H,3-4,7-12,14H2,1-2H3,(H,20,23)/p+1