[2-[[5-(dimethylsulfamoyl)-2-methoxy-phenyl]amino]-2-oxidanylidene-ethyl]-bis(furan-2-ylmethyl)azanium

Systemtic Name: [2-[[5-(dimethylsulfamoyl)-2-methoxy-phenyl]amino]-2-oxidanylidene-ethyl]-bis(furan-2-ylmethyl)azanium Openeye Name: [2-[5-(dimethylsulfamoyl)-2-methoxy-anilino]-2-oxo-ethyl]-bis(2-furylmethyl)ammonium CAS Name: [2-[5-(dimethylsulfamoyl)-2-methoxyanilino]-2-oxoethyl]-bis(2-furanylmethyl)ammonium IUPAC Name: [2-[5-(dimethylsulfamoyl)-2-methoxyanilino]-2-oxoethyl]-bis(furan-2-ylmethyl)azanium Traditional Name: [2-[5-(dimethylsulfamoyl)-2-methoxy-anilino]-2-keto-ethyl]-bis(2-furfuryl)ammonium Formula: C21H26N3O6S+ MolecularWeight: 448.51264

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC(=C(C=C1)OC)NC(=O)C[NH+](CC2=CC=CO2)CC3=CC=CO3

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC(=C(C=C1)OC)NC(=O)C[NH+](CC2=CC=CO2)CC3=CC=CO3

InChI

InChI=1S/C21H25N3O6S/c1-23(2)31(26,27)18-8-9-20(28-3)19(12-18)22-21(25)15-24(13-16-6-4-10-29-16)14-17-7-5-11-30-17/h4-12H,13-15H2,1-3H3,(H,22,25)/p+1