3-[4-[(2-methylphenyl)sulfamoyl]phenyl]propylazanium

Systemtic Name: 3-[4-[(2-methylphenyl)sulfamoyl]phenyl]propylazanium Openeye Name: 3-[4-(o-tolylsulfamoyl)phenyl]propylammonium CAS Name: 3-[4-[(2-methylphenyl)sulfamoyl]phenyl]propylammonium IUPAC Name: 3-[4-[(2-methylphenyl)sulfamoyl]phenyl]propylazanium Traditional Name: 3-[4-(o-tolylsulfamoyl)phenyl]propylammonium Formula: C16H21N2O2S+ MolecularWeight: 305.41514

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NS(=O)(=O)C2=CC=C(C=C2)CCC[NH3+]

Isomeric SMILES

CC1=CC=CC=C1NS(=O)(=O)C2=CC=C(C=C2)CCC[NH3+]

InChI

InChI=1S/C16H20N2O2S/c1-13-5-2-3-7-16(13)18-21(19,20)15-10-8-14(9-11-15)6-4-12-17/h2-3,5,7-11,18H,4,6,12,17H2,1H3/p+1