[4-[[(2S)-pentan-2-yl]sulfamoyl]phenyl]methylazanium

Systemtic Name: [4-[[(2S)-pentan-2-yl]sulfamoyl]phenyl]methylazanium Openeye Name: [4-[[(1S)-1-methylbutyl]sulfamoyl]phenyl]methylammonium CAS Name: [4-[[(2S)-pentan-2-yl]sulfamoyl]phenyl]methylammonium IUPAC Name: [4-[[(2S)-pentan-2-yl]sulfamoyl]phenyl]methylazanium Traditional Name: [4-[[(1S)-1-methylbutyl]sulfamoyl]benzyl]ammonium Formula: C12H21N2O2S+ MolecularWeight: 257.37234

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)NS(=O)(=O)C1=CC=C(C=C1)C[NH3+]

Isomeric SMILES

CCC[C@H](C)NS(=O)(=O)C1=CC=C(C=C1)C[NH3+]

InChI

InChI=1S/C12H20N2O2S/c1-3-4-10(2)14-17(15,16)12-7-5-11(9-13)6-8-12/h5-8,10,14H,3-4,9,13H2,1-2H3/p+1/t10-/m0/s1