4-oxidanylidene-3-sulfo-4-tetradecan-7-yloxy-butanoic acid

Systemtic Name: 4-oxidanylidene-3-sulfo-4-tetradecan-7-yloxy-butanoic acid Openeye Name: 4-(1-hexyloctoxy)-4-oxo-3-sulfo-butanoic acid CAS Name: 4-oxo-3-sulfo-4-tetradecan-7-yloxybutanoic acid IUPAC Name: 4-oxo-3-sulfo-4-tetradecan-7-yloxybutanoic acid Traditional Name: 4-(1-hexyloctoxy)-4-keto-3-sulfo-butyric acid Formula: C18H34O7S MolecularWeight: 394.52336

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(CCCCCC)OC(=O)C(CC(=O)O)S(=O)(=O)O

Isomeric SMILES

CCCCCCCC(CCCCCC)OC(=O)C(CC(=O)O)S(=O)(=O)O

InChI

InChI=1S/C18H34O7S/c1-3-5-7-9-11-13-15(12-10-8-6-4-2)25-18(21)16(14-17(19)20)26(22,23)24/h15-16H,3-14H2,1-2H3,(H,19,20)(H,22,23,24)