[3-(pentan-3-ylsulfamoyl)phenyl]methylazanium

Systemtic Name: [3-(pentan-3-ylsulfamoyl)phenyl]methylazanium Openeye Name: [3-(1-ethylpropylsulfamoyl)phenyl]methylammonium CAS Name: [3-(pentan-3-ylsulfamoyl)phenyl]methylammonium IUPAC Name: [3-(pentan-3-ylsulfamoyl)phenyl]methylazanium Traditional Name: [3-(1-ethylpropylsulfamoyl)benzyl]ammonium Formula: C12H21N2O2S+ MolecularWeight: 257.37234

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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