O1-octyl O4-sulfo butanedioate

Systemtic Name: O1-octyl O4-sulfo butanedioate Openeye Name: O1-octyl O4-sulfo butanedioate CAS Name: butanedioic acid O1-octyl ester O4-sulfo ester IUPAC Name: 1-O-octyl 4-O-sulfo butanedioate Traditional Name: succinic acid O1-octyl ester O4-sulfo ester Formula: C12H22O7S MolecularWeight: 310.36388

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC(=O)CCC(=O)OS(=O)(=O)O

Isomeric SMILES

CCCCCCCCOC(=O)CCC(=O)OS(=O)(=O)O

InChI

InChI=1S/C12H22O7S/c1-2-3-4-5-6-7-10-18-11(13)8-9-12(14)19-20(15,16)17/h2-10H2,1H3,(H,15,16,17)