3-[3-(dimethylamino)propyl-(4-methylphenyl)sulfonyl-amino]propane-1-sulfonic acid

Systemtic Name: 3-[3-(dimethylamino)propyl-(4-methylphenyl)sulfonyl-amino]propane-1-sulfonic acid Openeye Name: 3-[3-(dimethylamino)propyl-(p-tolylsulfonyl)amino]propane-1-sulfonic acid CAS Name: 3-[3-(dimethylamino)propyl-(4-methylphenyl)sulfonylamino]-1-propanesulfonic acid IUPAC Name: 3-[3-(dimethylamino)propyl-(4-methylphenyl)sulfonylamino]propane-1-sulfonic acid Traditional Name: 3-[3-(dimethylamino)propyl-tosyl-amino]propane-1-sulfonic acid Formula: C15H26N2O5S2 MolecularWeight: 378.50734

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(CCCN(C)C)CCCS(=O)(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(CCCN(C)C)CCCS(=O)(=O)O

InChI

InChI=1S/C15H26N2O5S2/c1-14-6-8-15(9-7-14)24(21,22)17(11-4-10-16(2)3)12-5-13-23(18,19)20/h6-9H,4-5,10-13H2,1-3H3,(H,18,19,20)