3-[(4-methylphenyl)-methylsulfonyl-amino]propylazanium

Systemtic Name: 3-[(4-methylphenyl)-methylsulfonyl-amino]propylazanium Openeye Name: 3-(4-methyl-N-methylsulfonyl-anilino)propylammonium CAS Name: 3-(4-methyl-N-methylsulfonylanilino)propylammonium IUPAC Name: 3-(4-methyl-N-methylsulfonylanilino)propylazanium Traditional Name: 3-(N-mesyl-4-methyl-anilino)propylammonium Formula: C11H19N2O2S+ MolecularWeight: 243.34576

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H18N2O2S/c1-10-4-6-11(7-5-10)13(9-3-8-12)16(2,14)15/h4-7H,3,8-9,12H2,1-2H3/p+1