5-[(2-chlorophenyl)methylsulfonylmethyl]-N-(3-morpholin-4-ium-4-ylpropyl)furan-2-carboxamide

Systemtic Name: 5-[(2-chlorophenyl)methylsulfonylmethyl]-N-(3-morpholin-4-ium-4-ylpropyl)furan-2-carboxamide Openeye Name: 5-[(2-chlorophenyl)methylsulfonylmethyl]-N-(3-morpholin-4-ium-4-ylpropyl)furan-2-carboxamide CAS Name: 5-[(2-chlorophenyl)methylsulfonylmethyl]-N-[3-(4-morpholin-4-iumyl)propyl]-2-furancarboxamide IUPAC Name: 5-[(2-chlorophenyl)methylsulfonylmethyl]-N-(3-morpholin-4-ium-4-ylpropyl)furan-2-carboxamide Traditional Name: 5-[(2-chlorobenzyl)sulfonylmethyl]-N-(3-morpholin-4-ium-4-ylpropyl)-2-furamide Formula: C20H26ClN2O5S+ MolecularWeight: 441.94884

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCCNC(=O)C2=CC=C(O2)CS(=O)(=O)CC3=CC=CC=C3Cl

Isomeric SMILES

C1COCC[NH+]1CCCNC(=O)C2=CC=C(O2)CS(=O)(=O)CC3=CC=CC=C3Cl

InChI

InChI=1S/C20H25ClN2O5S/c21-18-5-2-1-4-16(18)14-29(25,26)15-17-6-7-19(28-17)20(24)22-8-3-9-23-10-12-27-13-11-23/h1-2,4-7H,3,8-15H2,(H,22,24)/p+1