2-[2-[(3,5-dimethylphenyl)-methylsulfonyl-amino]ethanoylamino]ethyl-dimethyl-azanium

Systemtic Name: 2-[2-[(3,5-dimethylphenyl)-methylsulfonyl-amino]ethanoylamino]ethyl-dimethyl-azanium Openeye Name: 2-[[2-(3,5-dimethyl-N-methylsulfonyl-anilino)acetyl]amino]ethyl-dimethyl-ammonium CAS Name: 2-[[2-(3,5-dimethyl-N-methylsulfonylanilino)-1-oxoethyl]amino]ethyl-dimethylammonium IUPAC Name: 2-[[2-(3,5-dimethyl-N-methylsulfonylanilino)acetyl]amino]ethyl-dimethylazanium Traditional Name: 2-[[2-(N-mesyl-3,5-dimethyl-anilino)acetyl]amino]ethyl-dimethyl-ammonium Formula: C15H26N3O3S+ MolecularWeight: 328.45024

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)N(CC(=O)NCC[NH+](C)C)S(=O)(=O)C)C

Isomeric SMILES

CC1=CC(=CC(=C1)N(CC(=O)NCC[NH+](C)C)S(=O)(=O)C)C

InChI

InChI=1S/C15H25N3O3S/c1-12-8-13(2)10-14(9-12)18(22(5,20)21)11-15(19)16-6-7-17(3)4/h8-10H,6-7,11H2,1-5H3,(H,16,19)/p+1