N-[(2R)-2-(furan-2-yl)-2-(4-methylpiperidin-1-ium-1-yl)ethyl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide

Systemtic Name: N-[(2R)-2-(furan-2-yl)-2-(4-methylpiperidin-1-ium-1-yl)ethyl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide Openeye Name: N-[(2R)-2-(2-furyl)-2-(4-methylpiperidin-1-ium-1-yl)ethyl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide CAS Name: N-[(2R)-2-(2-furanyl)-2-(4-methyl-1-piperidin-1-iumyl)ethyl]-2,3-dihydro-1,4-benzodioxin-6-sulfonamide IUPAC Name: N-[(2R)-2-(furan-2-yl)-2-(4-methylpiperidin-1-ium-1-yl)ethyl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide Traditional Name: N-[(2R)-2-(2-furyl)-2-(4-methylpiperidin-1-ium-1-yl)ethyl]-2,3-dihydro-1,4-benzodioxin-6-sulfonamide Formula: C20H27N2O5S+ MolecularWeight: 407.50378

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC[NH+](CC1)C(CNS(=O)(=O)C2=CC3=C(C=C2)OCCO3)C4=CC=CO4

Isomeric SMILES

CC1CC[NH+](CC1)[C@H](CNS(=O)(=O)C2=CC3=C(C=C2)OCCO3)C4=CC=CO4

InChI

InChI=1S/C20H26N2O5S/c1-15-6-8-22(9-7-15)17(18-3-2-10-25-18)14-21-28(23,24)16-4-5-19-20(13-16)27-12-11-26-19/h2-5,10,13,15,17,21H,6-9,11-12,14H2,1H3/p+1/t17-/m1/s1