4-[(2-methoxyphenyl)-methyl-sulfamoyl]-N-(3-morpholin-4-ium-4-ylpropyl)benzamide

Systemtic Name: 4-[(2-methoxyphenyl)-methyl-sulfamoyl]-N-(3-morpholin-4-ium-4-ylpropyl)benzamide Openeye Name: 4-[(2-methoxyphenyl)-methyl-sulfamoyl]-N-(3-morpholin-4-ium-4-ylpropyl)benzamide CAS Name: 4-[(2-methoxyphenyl)-methylsulfamoyl]-N-[3-(4-morpholin-4-iumyl)propyl]benzamide IUPAC Name: 4-[(2-methoxyphenyl)-methylsulfamoyl]-N-(3-morpholin-4-ium-4-ylpropyl)benzamide Traditional Name: 4-[(2-methoxyphenyl)-methyl-sulfamoyl]-N-(3-morpholin-4-ium-4-ylpropyl)benzamide Formula: C22H30N3O5S+ MolecularWeight: 448.5557

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=CC=C1OC)S(=O)(=O)C2=CC=C(C=C2)C(=O)NCCC[NH+]3CCOCC3

Isomeric SMILES

CN(C1=CC=CC=C1OC)S(=O)(=O)C2=CC=C(C=C2)C(=O)NCCC[NH+]3CCOCC3

InChI

InChI=1S/C22H29N3O5S/c1-24(20-6-3-4-7-21(20)29-2)31(27,28)19-10-8-18(9-11-19)22(26)23-12-5-13-25-14-16-30-17-15-25/h3-4,6-11H,5,12-17H2,1-2H3,(H,23,26)/p+1