3-[(3-methylphenyl)-(phenylsulfonyl)amino]propylazanium

Systemtic Name: 3-[(3-methylphenyl)-(phenylsulfonyl)amino]propylazanium Openeye Name: 3-[N-(benzenesulfonyl)-3-methyl-anilino]propylammonium CAS Name: 3-[N-(benzenesulfonyl)-3-methylanilino]propylammonium IUPAC Name: 3-[N-(benzenesulfonyl)-3-methylanilino]propylazanium Traditional Name: 3-(N-besyl-3-methyl-anilino)propylammonium Formula: C16H21N2O2S+ MolecularWeight: 305.41514

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H20N2O2S/c1-14-7-5-8-15(13-14)18(12-6-11-17)21(19,20)16-9-3-2-4-10-16/h2-5,7-10,13H,6,11-12,17H2,1H3/p+1