[(1S)-2-[[3-(1,3-benzodioxol-5-ylmethylsulfamoyl)phenyl]carbonylamino]-1-phenyl-ethyl]-dimethyl-azanium

Systemtic Name: [(1S)-2-[[3-(1,3-benzodioxol-5-ylmethylsulfamoyl)phenyl]carbonylamino]-1-phenyl-ethyl]-dimethyl-azanium Openeye Name: [(1S)-2-[[3-(1,3-benzodioxol-5-ylmethylsulfamoyl)benzoyl]amino]-1-phenyl-ethyl]-dimethyl-ammonium CAS Name: [(1S)-2-[[[3-(1,3-benzodioxol-5-ylmethylsulfamoyl)phenyl]-oxomethyl]amino]-1-phenylethyl]-dimethylammonium IUPAC Name: [(1S)-2-[[3-(1,3-benzodioxol-5-ylmethylsulfamoyl)benzoyl]amino]-1-phenylethyl]-dimethylazanium Traditional Name: dimethyl-[(1S)-1-phenyl-2-[[3-(piperonylsulfamoyl)benzoyl]amino]ethyl]ammonium Formula: C25H28N3O5S+ MolecularWeight: 482.57192

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)C(CNC(=O)C1=CC(=CC=C1)S(=O)(=O)NCC2=CC3=C(C=C2)OCO3)C4=CC=CC=C4

Isomeric SMILES

C[NH+](C)[C@H](CNC(=O)C1=CC(=CC=C1)S(=O)(=O)NCC2=CC3=C(C=C2)OCO3)C4=CC=CC=C4

InChI

InChI=1S/C25H27N3O5S/c1-28(2)22(19-7-4-3-5-8-19)16-26-25(29)20-9-6-10-21(14-20)34(30,31)27-15-18-11-12-23-24(13-18)33-17-32-23/h3-14,22,27H,15-17H2,1-2H3,(H,26,29)/p+1/t22-/m1/s1