[4-[[(2S)-butan-2-yl]sulfamoylmethyl]phenyl]methylazanium

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NS(=O)(=O)CC1=CC=C(C=C1)C[NH3+]

Isomeric SMILES

CC[C@H](C)NS(=O)(=O)CC1=CC=C(C=C1)C[NH3+]

InChI

InChI=1S/C12H20N2O2S/c1-3-10(2)14-17(15,16)9-12-6-4-11(8-13)5-7-12/h4-7,10,14H,3,8-9,13H2,1-2H3/p+1/t10-/m0/s1