2-[(3,4-dimethylphenyl)sulfonyl-ethyl-amino]ethylazanium

Systemtic Name: 2-[(3,4-dimethylphenyl)sulfonyl-ethyl-amino]ethylazanium Openeye Name: 2-[(3,4-dimethylphenyl)sulfonyl-ethyl-amino]ethylammonium CAS Name: 2-[(3,4-dimethylphenyl)sulfonyl-ethylamino]ethylammonium IUPAC Name: 2-[(3,4-dimethylphenyl)sulfonyl-ethylamino]ethylazanium Traditional Name: 2-[(3,4-dimethylphenyl)sulfonyl-ethyl-amino]ethylammonium Formula: C12H21N2O2S+ MolecularWeight: 257.37234

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC[NH3+])S(=O)(=O)C1=CC(=C(C=C1)C)C

Isomeric SMILES

CCN(CC[NH3+])S(=O)(=O)C1=CC(=C(C=C1)C)C

InChI

InChI=1S/C12H20N2O2S/c1-4-14(8-7-13)17(15,16)12-6-5-10(2)11(3)9-12/h5-6,9H,4,7-8,13H2,1-3H3/p+1