2-(2-azanyl-2-oxidanylidene-1-sulfo-ethyl)-2-octyl-dodecanoic acid

Systemtic Name: 2-(2-azanyl-2-oxidanylidene-1-sulfo-ethyl)-2-octyl-dodecanoic acid Openeye Name: 2-(2-amino-2-oxo-1-sulfo-ethyl)-2-octyl-dodecanoic acid CAS Name: 2-(2-amino-2-oxo-1-sulfoethyl)-2-octyldodecanoic acid IUPAC Name: 2-(2-amino-2-oxo-1-sulfoethyl)-2-octyldodecanoic acid Traditional Name: 2-(2-amino-2-keto-1-sulfo-ethyl)-2-octyl-lauric acid Formula: C22H43NO6S MolecularWeight: 449.64492

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC(CCCCCCCC)(C(C(=O)N)S(=O)(=O)O)C(=O)O

Isomeric SMILES

CCCCCCCCCCC(CCCCCCCC)(C(C(=O)N)S(=O)(=O)O)C(=O)O

InChI

InChI=1S/C22H43NO6S/c1-3-5-7-9-11-12-14-16-18-22(21(25)26,17-15-13-10-8-6-4-2)19(20(23)24)30(27,28)29/h19H,3-18H2,1-2H3,(H2,23,24)(H,25,26)(H,27,28,29)