[2,2-dimethyl-3-[(4-methylsulfonyl-2-nitro-phenyl)amino]propyl]-dimethyl-azanium

Systemtic Name: [2,2-dimethyl-3-[(4-methylsulfonyl-2-nitro-phenyl)amino]propyl]-dimethyl-azanium Openeye Name: [2,2-dimethyl-3-(4-methylsulfonyl-2-nitro-anilino)propyl]-dimethyl-ammonium CAS Name: [2,2-dimethyl-3-(4-methylsulfonyl-2-nitroanilino)propyl]-dimethylammonium IUPAC Name: [2,2-dimethyl-3-(4-methylsulfonyl-2-nitroanilino)propyl]-dimethylazanium Traditional Name: [3-(4-mesyl-2-nitro-anilino)-2,2-dimethyl-propyl]-dimethyl-ammonium Formula: C14H24N3O4S+ MolecularWeight: 330.42306

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CNC1=C(C=C(C=C1)S(=O)(=O)C)[N+](=O)[O-])C[NH+](C)C

Isomeric SMILES

CC(C)(CNC1=C(C=C(C=C1)S(=O)(=O)C)[N+](=O)[O-])C[NH+](C)C

InChI

InChI=1S/C14H23N3O4S/c1-14(2,10-16(3)4)9-15-12-7-6-11(22(5,20)21)8-13(12)17(18)19/h6-8,15H,9-10H2,1-5H3/p+1