[4-(3-methylbutylsulfamoylmethyl)phenyl]methylazanium

Systemtic Name: [4-(3-methylbutylsulfamoylmethyl)phenyl]methylazanium Openeye Name: [4-(isopentylsulfamoylmethyl)phenyl]methylammonium CAS Name: [4-(3-methylbutylsulfamoylmethyl)phenyl]methylammonium IUPAC Name: [4-(3-methylbutylsulfamoylmethyl)phenyl]methylazanium Traditional Name: [4-(isoamylsulfamoylmethyl)benzyl]ammonium Formula: C13H23N2O2S+ MolecularWeight: 271.39892

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H22N2O2S/c1-11(2)7-8-15-18(16,17)10-13-5-3-12(9-14)4-6-13/h3-6,11,15H,7-10,14H2,1-2H3/p+1