bis(2-hydroxyethyl)-methyl-(3-oxidanylpropyl)azanium; 2-[bis(2-oxidanylbutyl)amino]ethanesulfonate

Systemtic Name: bis(2-hydroxyethyl)-methyl-(3-oxidanylpropyl)azanium; 2-[bis(2-oxidanylbutyl)amino]ethanesulfonate Openeye Name: 2-[bis(2-hydroxybutyl)amino]ethanesulfonate; bis(2-hydroxyethyl)-(3-hydroxypropyl)-methyl-ammonium CAS Name: 2-[bis(2-hydroxybutyl)amino]ethanesulfonate; bis(2-hydroxyethyl)-(3-hydroxypropyl)-methylammonium IUPAC Name: 2-[bis(2-hydroxybutyl)amino]ethanesulfonate; bis(2-hydroxyethyl)-(3-hydroxypropyl)-methylazanium Traditional Name: 2-[bis(2-hydroxybutyl)amino]ethanesulfonate; bis(2-hydroxyethyl)-(3-hydroxypropyl)-methyl-ammonium Formula: C18H42N2O8S MolecularWeight: 446.59968

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CN(CCS(=O)(=O)[O-])CC(CC)O)O.C[N+](CCCO)(CCO)CCO

Isomeric SMILES

CCC(CN(CCS(=O)(=O)[O-])CC(CC)O)O.C[N+](CCCO)(CCO)CCO

InChI

InChI=1S/C10H23NO5S.C8H20NO3/c1-3-9(12)7-11(8-10(13)4-2)5-6-17(14,15)16;1-9(4-7-11,5-8-12)3-2-6-10/h9-10,12-13H,3-8H2,1-2H3,(H,14,15,16);10-12H,2-8H2,1H3/q;+1/p-1