3-[(3-azanyl-5-chloranyl-4-methyl-phenyl)sulfonylamino]propyl-dimethyl-azanium

Systemtic Name: 3-[(3-azanyl-5-chloranyl-4-methyl-phenyl)sulfonylamino]propyl-dimethyl-azanium Openeye Name: 3-[(3-amino-5-chloro-4-methyl-phenyl)sulfonylamino]propyl-dimethyl-ammonium CAS Name: 3-[(3-amino-5-chloro-4-methylphenyl)sulfonylamino]propyl-dimethylammonium IUPAC Name: 3-[(3-amino-5-chloro-4-methylphenyl)sulfonylamino]propyl-dimethylazanium Traditional Name: 3-[(3-amino-5-chloro-4-methyl-phenyl)sulfonylamino]propyl-dimethyl-ammonium Formula: C12H21ClN3O2S+ MolecularWeight: 306.83204

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1N)S(=O)(=O)NCCC[NH+](C)C)Cl

Isomeric SMILES

CC1=C(C=C(C=C1N)S(=O)(=O)NCCC[NH+](C)C)Cl

InChI

InChI=1S/C12H20ClN3O2S/c1-9-11(13)7-10(8-12(9)14)19(17,18)15-5-4-6-16(2)3/h7-8,15H,4-6,14H2,1-3H3/p+1