sodium 2-[2-[3-[(4-methylphenyl)sulfonylamino]propylamino]ethoxy]ethyl sulfate

Systemtic Name: sodium 2-[2-[3-[(4-methylphenyl)sulfonylamino]propylamino]ethoxy]ethyl sulfate Openeye Name: sodium 2-[2-[3-(p-tolylsulfonylamino)propylamino]ethoxy]ethyl sulfate CAS Name: sodium 2-[2-[3-[(4-methylphenyl)sulfonylamino]propylamino]ethoxy]ethyl sulfate IUPAC Name: sodium 2-[2-[3-[(4-methylphenyl)sulfonylamino]propylamino]ethoxy]ethyl sulfate Traditional Name: sodium 2-[2-[3-(tosylamino)propylamino]ethoxy]ethyl sulfate Formula: C14H23N2NaO7S2 MolecularWeight: 418.46139

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NCCCNCCOCCOS(=O)(=O)[O-].[Na+]

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NCCCNCCOCCOS(=O)(=O)[O-].[Na+]

InChI

InChI=1S/C14H24N2O7S2.Na/c1-13-3-5-14(6-4-13)24(17,18)16-8-2-7-15-9-10-22-11-12-23-25(19,20)21;/h3-6,15-16H,2,7-12H2,1H3,(H,19,20,21);/q;+1/p-1