2-(4-methoxy-3-morpholin-4-ylsulfonyl-phenyl)-N-[[2-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]ethanamide

Systemtic Name: 2-(4-methoxy-3-morpholin-4-ylsulfonyl-phenyl)-N-[[2-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]ethanamide Openeye Name: 2-(4-methoxy-3-morpholinosulfonyl-phenyl)-N-[[2-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]acetamide CAS Name: 2-[4-methoxy-3-(4-morpholinylsulfonyl)phenyl]-N-[[2-(1-pyrrolidin-1-iumylmethyl)phenyl]methyl]acetamide IUPAC Name: 2-(4-methoxy-3-morpholin-4-ylsulfonylphenyl)-N-[[2-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]acetamide Traditional Name: 2-(4-methoxy-3-morpholinosulfonyl-phenyl)-N-[2-(pyrrolidin-1-ium-1-ylmethyl)benzyl]acetamide Formula: C25H34N3O5S+ MolecularWeight: 488.61956

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CC(=O)NCC2=CC=CC=C2C[NH+]3CCCC3)S(=O)(=O)N4CCOCC4

Isomeric SMILES

COC1=C(C=C(C=C1)CC(=O)NCC2=CC=CC=C2C[NH+]3CCCC3)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C25H33N3O5S/c1-32-23-9-8-20(16-24(23)34(30,31)28-12-14-33-15-13-28)17-25(29)26-18-21-6-2-3-7-22(21)19-27-10-4-5-11-27/h2-3,6-9,16H,4-5,10-15,17-19H2,1H3,(H,26,29)/p+1