2-[(3,5-dimethylphenyl)-(phenylsulfonyl)amino]ethylazanium

Systemtic Name: 2-[(3,5-dimethylphenyl)-(phenylsulfonyl)amino]ethylazanium Openeye Name: 2-[N-(benzenesulfonyl)-3,5-dimethyl-anilino]ethylammonium CAS Name: 2-[N-(benzenesulfonyl)-3,5-dimethylanilino]ethylammonium IUPAC Name: 2-[N-(benzenesulfonyl)-3,5-dimethylanilino]ethylazanium Traditional Name: 2-(N-besyl-3,5-dimethyl-anilino)ethylammonium Formula: C16H21N2O2S+ MolecularWeight: 305.41514

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)N(CC[NH3+])S(=O)(=O)C2=CC=CC=C2)C

Isomeric SMILES

CC1=CC(=CC(=C1)N(CC[NH3+])S(=O)(=O)C2=CC=CC=C2)C

InChI

InChI=1S/C16H20N2O2S/c1-13-10-14(2)12-15(11-13)18(9-8-17)21(19,20)16-6-4-3-5-7-16/h3-7,10-12H,8-9,17H2,1-2H3/p+1