2-[(4-bromophenyl)sulfonyl-methyl-amino]-N-(3-morpholin-4-ium-4-ylpropyl)ethanamide

Systemtic Name: 2-[(4-bromophenyl)sulfonyl-methyl-amino]-N-(3-morpholin-4-ium-4-ylpropyl)ethanamide Openeye Name: 2-[(4-bromophenyl)sulfonyl-methyl-amino]-N-(3-morpholin-4-ium-4-ylpropyl)acetamide CAS Name: 2-[(4-bromophenyl)sulfonyl-methylamino]-N-[3-(4-morpholin-4-iumyl)propyl]acetamide IUPAC Name: 2-[(4-bromophenyl)sulfonyl-methylamino]-N-(3-morpholin-4-ium-4-ylpropyl)acetamide Traditional Name: 2-[brosyl(methyl)amino]-N-(3-morpholin-4-ium-4-ylpropyl)acetamide Formula: C16H25BrN3O4S+ MolecularWeight: 435.3564

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)NCCC[NH+]1CCOCC1)S(=O)(=O)C2=CC=C(C=C2)Br

Isomeric SMILES

CN(CC(=O)NCCC[NH+]1CCOCC1)S(=O)(=O)C2=CC=C(C=C2)Br

InChI

InChI=1S/C16H24BrN3O4S/c1-19(25(22,23)15-5-3-14(17)4-6-15)13-16(21)18-7-2-8-20-9-11-24-12-10-20/h3-6H,2,7-13H2,1H3,(H,18,21)/p+1