[(2S)-heptan-2-yl]-[(4-sulfamoylphenyl)methyl]azanium

Systemtic Name: [(2S)-heptan-2-yl]-[(4-sulfamoylphenyl)methyl]azanium Openeye Name: [(1S)-1-methylhexyl]-[(4-sulfamoylphenyl)methyl]ammonium CAS Name: [(2S)-heptan-2-yl]-[(4-sulfamoylphenyl)methyl]ammonium IUPAC Name: [(2S)-heptan-2-yl]-[(4-sulfamoylphenyl)methyl]azanium Traditional Name: [(1S)-1-methylhexyl]-(4-sulfamoylbenzyl)ammonium Formula: C14H25N2O2S+ MolecularWeight: 285.4255

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)[NH2+]CC1=CC=C(C=C1)S(=O)(=O)N

Isomeric SMILES

CCCCC[C@H](C)[NH2+]CC1=CC=C(C=C1)S(=O)(=O)N

InChI

InChI=1S/C14H24N2O2S/c1-3-4-5-6-12(2)16-11-13-7-9-14(10-8-13)19(15,17)18/h7-10,12,16H,3-6,11H2,1-2H3,(H2,15,17,18)/p+1/t12-/m0/s1