2-(7-fluoranylnonadecan-7-yl)-2-sulfo-butanedioate

Systemtic Name: 2-(7-fluoranylnonadecan-7-yl)-2-sulfo-butanedioate Openeye Name: 2-(1-fluoro-1-hexyl-tridecyl)-2-sulfo-butanedioate CAS Name: 2-(7-fluorononadecan-7-yl)-2-sulfobutanedioate IUPAC Name: 2-(7-fluorononadecan-7-yl)-2-sulfobutanedioate Traditional Name: 2-(1-fluoro-1-hexyl-tridecyl)-2-sulfo-succinate Formula: C23H41FO7S-2 MolecularWeight: 480.630843

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC(CCCCCC)(C(CC(=O)[O-])(C(=O)[O-])S(=O)(=O)O)F

Isomeric SMILES

CCCCCCCCCCCCC(CCCCCC)(C(CC(=O)[O-])(C(=O)[O-])S(=O)(=O)O)F

InChI

InChI=1S/C23H43FO7S/c1-3-5-7-9-10-11-12-13-14-16-18-22(24,17-15-8-6-4-2)23(21(27)28,19-20(25)26)32(29,30)31/h3-19H2,1-2H3,(H,25,26)(H,27,28)(H,29,30,31)/p-2