4-(1-oxidanylhexadecoxy)-4-oxidanylidene-3-sulfo-butanoate

Systemtic Name: 4-(1-oxidanylhexadecoxy)-4-oxidanylidene-3-sulfo-butanoate Openeye Name: 4-(1-hydroxyhexadecoxy)-4-oxo-3-sulfo-butanoate CAS Name: 4-(1-hydroxyhexadecoxy)-4-oxo-3-sulfobutanoate IUPAC Name: 4-(1-hydroxyhexadecoxy)-4-oxo-3-sulfobutanoate Traditional Name: 4-(1-hydroxyhexadecoxy)-4-keto-3-sulfo-butyrate Formula: C20H37O8S- MolecularWeight: 437.56798

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(O)OC(=O)C(CC(=O)[O-])S(=O)(=O)O

Isomeric SMILES

CCCCCCCCCCCCCCCC(O)OC(=O)C(CC(=O)[O-])S(=O)(=O)O

InChI

InChI=1S/C20H38O8S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-19(23)28-20(24)17(16-18(21)22)29(25,26)27/h17,19,23H,2-16H2,1H3,(H,21,22)(H,25,26,27)/p-1