[4-[butyl(methyl)sulfamoyl]phenyl]methylazanium

Systemtic Name: [4-[butyl(methyl)sulfamoyl]phenyl]methylazanium Openeye Name: [4-[butyl(methyl)sulfamoyl]phenyl]methylammonium CAS Name: [4-[butyl(methyl)sulfamoyl]phenyl]methylammonium IUPAC Name: [4-[butyl(methyl)sulfamoyl]phenyl]methylazanium Traditional Name: [4-[butyl(methyl)sulfamoyl]benzyl]ammonium Formula: C12H21N2O2S+ MolecularWeight: 257.37234

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C)S(=O)(=O)C1=CC=C(C=C1)C[NH3+]

Isomeric SMILES

CCCCN(C)S(=O)(=O)C1=CC=C(C=C1)C[NH3+]

InChI

InChI=1S/C12H20N2O2S/c1-3-4-9-14(2)17(15,16)12-7-5-11(10-13)6-8-12/h5-8H,3-4,9-10,13H2,1-2H3/p+1