trisodium 2-sulfo-3-tetradecoxy-butanedioate

Systemtic Name: trisodium 2-sulfo-3-tetradecoxy-butanedioate Openeye Name: trisodium 2-sulfo-3-tetradecoxy-butanedioate CAS Name: trisodium 2-sulfo-3-tetradecoxybutanedioate IUPAC Name: trisodium 2-sulfo-3-tetradecoxybutanedioate Traditional Name: trisodium 2-myristyloxy-3-sulfo-succinate Formula: C18H32Na3O8S+ MolecularWeight: 477.47619

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCOC(C(C(=O)[O-])S(=O)(=O)O)C(=O)[O-].[Na+].[Na+].[Na+]

Isomeric SMILES

CCCCCCCCCCCCCCOC(C(C(=O)[O-])S(=O)(=O)O)C(=O)[O-].[Na+].[Na+].[Na+]

InChI

InChI=1S/C18H34O8S.3Na/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-26-15(17(19)20)16(18(21)22)27(23,24)25;;;/h15-16H,2-14H2,1H3,(H,19,20)(H,21,22)(H,23,24,25);;;/q;3*+1/p-2