3-[(2,3-dimethyl-5-nitro-phenyl)sulfonylamino]propylazanium

Systemtic Name: 3-[(2,3-dimethyl-5-nitro-phenyl)sulfonylamino]propylazanium Openeye Name: 3-[(2,3-dimethyl-5-nitro-phenyl)sulfonylamino]propylammonium CAS Name: 3-[(2,3-dimethyl-5-nitrophenyl)sulfonylamino]propylammonium IUPAC Name: 3-[(2,3-dimethyl-5-nitrophenyl)sulfonylamino]propylazanium Traditional Name: 3-[(2,3-dimethyl-5-nitro-phenyl)sulfonylamino]propylammonium Formula: C11H18N3O4S+ MolecularWeight: 288.34332

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1C)S(=O)(=O)NCCC[NH3+])[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=CC(=C1C)S(=O)(=O)NCCC[NH3+])[N+](=O)[O-]

InChI

InChI=1S/C11H17N3O4S/c1-8-6-10(14(15)16)7-11(9(8)2)19(17,18)13-5-3-4-12/h6-7,13H,3-5,12H2,1-2H3/p+1