dimethyl-[[(4-methylphenyl)sulfonyl-(2-propoxyethyl)amino]methyl]-(3-sulfopropyl)azanium

Systemtic Name: dimethyl-[[(4-methylphenyl)sulfonyl-(2-propoxyethyl)amino]methyl]-(3-sulfopropyl)azanium Openeye Name: dimethyl-[[2-propoxyethyl(p-tolylsulfonyl)amino]methyl]-(3-sulfopropyl)ammonium CAS Name: dimethyl-[[(4-methylphenyl)sulfonyl-(2-propoxyethyl)amino]methyl]-(3-sulfopropyl)ammonium IUPAC Name: dimethyl-[[(4-methylphenyl)sulfonyl-(2-propoxyethyl)amino]methyl]-(3-sulfopropyl)azanium Traditional Name: dimethyl-[[2-propoxyethyl(tosyl)amino]methyl]-(3-sulfopropyl)ammonium Formula: C18H33N2O6S2+ MolecularWeight: 437.59442

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Descriptors Computed from Structure

Canonical SMILES:

CCCOCCN(C[N+](C)(C)CCCS(=O)(=O)O)S(=O)(=O)C1=CC=C(C=C1)C

Isomeric SMILES

CCCOCCN(C[N+](C)(C)CCCS(=O)(=O)O)S(=O)(=O)C1=CC=C(C=C1)C

InChI

InChI=1S/C18H32N2O6S2/c1-5-13-26-14-11-19(16-20(3,4)12-6-15-27(21,22)23)28(24,25)18-9-7-17(2)8-10-18/h7-10H,5-6,11-16H2,1-4H3/p+1