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

Systemtic Name: [4-[[(2S)-pentan-2-yl]sulfamoylmethyl]phenyl]methylazanium Openeye Name: [4-[[(1S)-1-methylbutyl]sulfamoylmethyl]phenyl]methylammonium CAS Name: [4-[[(2S)-pentan-2-yl]sulfamoylmethyl]phenyl]methylammonium IUPAC Name: [4-[[(2S)-pentan-2-yl]sulfamoylmethyl]phenyl]methylazanium Traditional Name: [4-[[(1S)-1-methylbutyl]sulfamoylmethyl]benzyl]ammonium Formula: C13H23N2O2S+ MolecularWeight: 271.39892

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H22N2O2S/c1-3-4-11(2)15-18(16,17)10-13-7-5-12(9-14)6-8-13/h5-8,11,15H,3-4,9-10,14H2,1-2H3/p+1/t11-/m0/s1