5-[(4-bromophenyl)sulfonylmethyl]-N-(2-morpholin-4-ium-4-ylethyl)furan-2-carboxamide

Systemtic Name: 5-[(4-bromophenyl)sulfonylmethyl]-N-(2-morpholin-4-ium-4-ylethyl)furan-2-carboxamide Openeye Name: 5-[(4-bromophenyl)sulfonylmethyl]-N-(2-morpholin-4-ium-4-ylethyl)furan-2-carboxamide CAS Name: 5-[(4-bromophenyl)sulfonylmethyl]-N-[2-(4-morpholin-4-iumyl)ethyl]-2-furancarboxamide IUPAC Name: 5-[(4-bromophenyl)sulfonylmethyl]-N-(2-morpholin-4-ium-4-ylethyl)furan-2-carboxamide Traditional Name: 5-(brosylmethyl)-N-(2-morpholin-4-ium-4-ylethyl)-2-furamide Formula: C18H22BrN2O5S+ MolecularWeight: 458.34668

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCNC(=O)C2=CC=C(O2)CS(=O)(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

C1COCC[NH+]1CCNC(=O)C2=CC=C(O2)CS(=O)(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C18H21BrN2O5S/c19-14-1-4-16(5-2-14)27(23,24)13-15-3-6-17(26-15)18(22)20-7-8-21-9-11-25-12-10-21/h1-6H,7-13H2,(H,20,22)/p+1