sodium 2-(1-pentylcyclopropyl)oxysulfonylbutanedioate

Systemtic Name: sodium 2-(1-pentylcyclopropyl)oxysulfonylbutanedioate Openeye Name: sodium 2-(1-pentylcyclopropoxy)sulfonylbutanedioate CAS Name: sodium 2-(1-pentylcyclopropyl)oxysulfonylbutanedioate IUPAC Name: sodium 2-(1-pentylcyclopropyl)oxysulfonylbutanedioate Traditional Name: sodium 2-(1-amylcyclopropoxy)sulfonylsuccinate Formula: C24H36NaO14S2-3 MolecularWeight: 635.65401

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1(CC1)OS(=O)(=O)C(CC(=O)[O-])C(=O)[O-].CCCCCC1(CC1)OS(=O)(=O)C(CC(=O)[O-])C(=O)[O-].[Na+]

Isomeric SMILES

CCCCCC1(CC1)OS(=O)(=O)C(CC(=O)[O-])C(=O)[O-].CCCCCC1(CC1)OS(=O)(=O)C(CC(=O)[O-])C(=O)[O-].[Na+]

InChI

InChI=1S/2C12H20O7S.Na/c2*1-2-3-4-5-12(6-7-12)19-20(17,18)9(11(15)16)8-10(13)14;/h2*9H,2-8H2,1H3,(H,13,14)(H,15,16);/q;;+1/p-4