2-(1-oxidanylundecan-4-yl)-2-sulfo-butanedioate

Systemtic Name: 2-(1-oxidanylundecan-4-yl)-2-sulfo-butanedioate Openeye Name: 2-[1-(3-hydroxypropyl)octyl]-2-sulfo-butanedioate CAS Name: 2-(1-hydroxyundecan-4-yl)-2-sulfobutanedioate IUPAC Name: 2-(1-hydroxyundecan-4-yl)-2-sulfobutanedioate Traditional Name: 2-[1-(3-hydroxypropyl)octyl]-2-sulfo-succinate Formula: C15H26O8S-2 MolecularWeight: 366.42714

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(CCCO)C(CC(=O)[O-])(C(=O)[O-])S(=O)(=O)O

Isomeric SMILES

CCCCCCCC(CCCO)C(CC(=O)[O-])(C(=O)[O-])S(=O)(=O)O

InChI

InChI=1S/C15H28O8S/c1-2-3-4-5-6-8-12(9-7-10-16)15(14(19)20,11-13(17)18)24(21,22)23/h12,16H,2-11H2,1H3,(H,17,18)(H,19,20)(H,21,22,23)/p-2