azanium 2-sulfo-2,3-di(tridecyl)butanedioate

Systemtic Name: azanium 2-sulfo-2,3-di(tridecyl)butanedioate Openeye Name: ammonium 2-sulfo-2,3-di(tridecyl)butanedioate CAS Name: ammonium 2-sulfo-2,3-di(tridecyl)butanedioate IUPAC Name: azanium 2-sulfo-2,3-di(tridecyl)butanedioate Traditional Name: ammonium 2-sulfo-2,3-di(tridecyl)succinate Formula: C30H60NO7S- MolecularWeight: 578.8649

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC(C(=O)[O-])C(CCCCCCCCCCCCC)(C(=O)[O-])S(=O)(=O)O.[NH4+]

Isomeric SMILES

CCCCCCCCCCCCCC(C(=O)[O-])C(CCCCCCCCCCCCC)(C(=O)[O-])S(=O)(=O)O.[NH4+]

InChI

InChI=1S/C30H58O7S.H3N/c1-3-5-7-9-11-13-15-17-19-21-23-25-27(28(31)32)30(29(33)34,38(35,36)37)26-24-22-20-18-16-14-12-10-8-6-4-2;/h27H,3-26H2,1-2H3,(H,31,32)(H,33,34)(H,35,36,37);1H3/p-1