N-(2-methoxydibenzofuran-3-yl)-2-[(3S)-3-(methylsulfonylaminomethyl)piperidin-1-ium-1-yl]ethanamide

Systemtic Name: N-(2-methoxydibenzofuran-3-yl)-2-[(3S)-3-(methylsulfonylaminomethyl)piperidin-1-ium-1-yl]ethanamide Openeye Name: 2-[(3S)-3-(methanesulfonamidomethyl)piperidin-1-ium-1-yl]-N-(2-methoxydibenzofuran-3-yl)acetamide CAS Name: 2-[(3S)-3-(methanesulfonamidomethyl)-1-piperidin-1-iumyl]-N-(2-methoxy-3-dibenzofuranyl)acetamide IUPAC Name: 2-[(3S)-3-(methanesulfonamidomethyl)piperidin-1-ium-1-yl]-N-(2-methoxydibenzofuran-3-yl)acetamide Traditional Name: 2-[(3S)-3-(methanesulfonamidomethyl)piperidin-1-ium-1-yl]-N-(2-methoxydibenzofuran-3-yl)acetamide Formula: C22H28N3O5S+ MolecularWeight: 446.53982

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C3=CC=CC=C3O2)NC(=O)C[NH+]4CCCC(C4)CNS(=O)(=O)C

Isomeric SMILES

COC1=C(C=C2C(=C1)C3=CC=CC=C3O2)NC(=O)C[NH+]4CCC[C@@H](C4)CNS(=O)(=O)C

InChI

InChI=1S/C22H27N3O5S/c1-29-21-10-17-16-7-3-4-8-19(16)30-20(17)11-18(21)24-22(26)14-25-9-5-6-15(13-25)12-23-31(2,27)28/h3-4,7-8,10-11,15,23H,5-6,9,12-14H2,1-2H3,(H,24,26)/p+1/t15-/m1/s1