4-dodecanoyloxy-4-oxidanylidene-3-sulfo-butanoic acid

Systemtic Name: 4-dodecanoyloxy-4-oxidanylidene-3-sulfo-butanoic acid Openeye Name: 4-dodecanoyloxy-4-oxo-3-sulfo-butanoic acid CAS Name: 4-oxo-4-(1-oxododecoxy)-3-sulfobutanoic acid IUPAC Name: 4-dodecanoyloxy-4-oxo-3-sulfobutanoic acid Traditional Name: 4-keto-4-lauroyloxy-3-sulfo-butyric acid Formula: C16H28O8S MolecularWeight: 380.45372

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=O)OC(=O)C(CC(=O)O)S(=O)(=O)O

Isomeric SMILES

CCCCCCCCCCCC(=O)OC(=O)C(CC(=O)O)S(=O)(=O)O

InChI

InChI=1S/C16H28O8S/c1-2-3-4-5-6-7-8-9-10-11-15(19)24-16(20)13(12-14(17)18)25(21,22)23/h13H,2-12H2,1H3,(H,17,18)(H,21,22,23)