O1-octyl O4-sulfo 2-prop-2-enylbutanedioate

Systemtic Name: O1-octyl O4-sulfo 2-prop-2-enylbutanedioate Openeye Name: O1-octyl O4-sulfo 2-allylbutanedioate CAS Name: 2-prop-2-enylbutanedioic acid O1-octyl ester O4-sulfo ester IUPAC Name: 1-O-octyl 4-O-sulfo 2-prop-2-enylbutanedioate Traditional Name: 2-allylsuccinic acid O1-octyl ester O4-sulfo ester Formula: C15H26O7S MolecularWeight: 350.42774

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC(=O)C(CC=C)CC(=O)OS(=O)(=O)O

Isomeric SMILES

CCCCCCCCOC(=O)C(CC=C)CC(=O)OS(=O)(=O)O

InChI

InChI=1S/C15H26O7S/c1-3-5-6-7-8-9-11-21-15(17)13(10-4-2)12-14(16)22-23(18,19)20/h4,13H,2-3,5-12H2,1H3,(H,18,19,20)