2-[methyl-(8-oxidanyl-8-oxidanylidene-octanoyl)amino]ethanesulfonate; triethylazanium

Systemtic Name: 2-[methyl-(8-oxidanyl-8-oxidanylidene-octanoyl)amino]ethanesulfonate; triethylazanium Openeye Name: 2-[(8-hydroxy-8-oxo-octanoyl)-methyl-amino]ethanesulfonate; triethylammonium CAS Name: 2-[(8-hydroxy-1,8-dioxooctyl)-methylamino]ethanesulfonate; triethylammonium IUPAC Name: 2-[(8-hydroxy-8-oxooctanoyl)-methylamino]ethanesulfonate; triethylazanium Traditional Name: 2-[(8-hydroxy-8-keto-octanoyl)-methyl-amino]ethanesulfonate; triethylammonium Formula: C17H36N2O6S MolecularWeight: 396.54254

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CC.CN(CCS(=O)(=O)[O-])C(=O)CCCCCCC(=O)O

Isomeric SMILES

CC[NH+](CC)CC.CN(CCS(=O)(=O)[O-])C(=O)CCCCCCC(=O)O

InChI

InChI=1S/C11H21NO6S.C6H15N/c1-12(8-9-19(16,17)18)10(13)6-4-2-3-5-7-11(14)15;1-4-7(5-2)6-3/h2-9H2,1H3,(H,14,15)(H,16,17,18);4-6H2,1-3H3