[4-methyl-3-(pentylsulfamoyl)phenyl]methylazanium

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNS(=O)(=O)C1=C(C=CC(=C1)C[NH3+])C

Isomeric SMILES

CCCCCNS(=O)(=O)C1=C(C=CC(=C1)C[NH3+])C

InChI

InChI=1S/C13H22N2O2S/c1-3-4-5-8-15-18(16,17)13-9-12(10-14)7-6-11(13)2/h6-7,9,15H,3-5,8,10,14H2,1-2H3/p+1