3-dodecanoyl-1-oxidanyl-4-oxidanylidene-pentadecan-2-olate

Systemtic Name: 3-dodecanoyl-1-oxidanyl-4-oxidanylidene-pentadecan-2-olate Openeye Name: 3-dodecanoyl-1-hydroxy-4-oxo-pentadecan-2-olate CAS Name: 1-hydroxy-4-oxo-3-(1-oxododecyl)-2-pentadecanolate IUPAC Name: 3-dodecanoyl-1-hydroxy-4-oxopentadecan-2-olate Traditional Name: 1-hydroxy-4-keto-3-lauroyl-pentadecan-2-olate Formula: C27H51O4- MolecularWeight: 439.69144

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=O)C(C(CO)[O-])C(=O)CCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCC(=O)C(C(CO)[O-])C(=O)CCCCCCCCCCC

InChI

InChI=1S/C27H51O4/c1-3-5-7-9-11-13-15-17-19-21-24(29)27(26(31)23-28)25(30)22-20-18-16-14-12-10-8-6-4-2/h26-28H,3-23H2,1-2H3/q-1