tert-butyl-[3-[[3-[(3-methylphenyl)sulfamoyl]phenyl]carbonylamino]propyl]azanium

Systemtic Name: tert-butyl-[3-[[3-[(3-methylphenyl)sulfamoyl]phenyl]carbonylamino]propyl]azanium Openeye Name: tert-butyl-[3-[[3-(m-tolylsulfamoyl)benzoyl]amino]propyl]ammonium CAS Name: tert-butyl-[3-[[[3-[(3-methylphenyl)sulfamoyl]phenyl]-oxomethyl]amino]propyl]ammonium IUPAC Name: tert-butyl-[3-[[3-[(3-methylphenyl)sulfamoyl]benzoyl]amino]propyl]azanium Traditional Name: tert-butyl-[3-[[3-(m-tolylsulfamoyl)benzoyl]amino]propyl]ammonium Formula: C21H30N3O3S+ MolecularWeight: 404.5462

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NS(=O)(=O)C2=CC=CC(=C2)C(=O)NCCC[NH2+]C(C)(C)C

Isomeric SMILES

CC1=CC(=CC=C1)NS(=O)(=O)C2=CC=CC(=C2)C(=O)NCCC[NH2+]C(C)(C)C

InChI

InChI=1S/C21H29N3O3S/c1-16-8-5-10-18(14-16)24-28(26,27)19-11-6-9-17(15-19)20(25)22-12-7-13-23-21(2,3)4/h5-6,8-11,14-15,23-24H,7,12-13H2,1-4H3,(H,22,25)/p+1