3-butyl-2,2-dihexyl-nonane-1,1,1-triolate

Systemtic Name: 3-butyl-2,2-dihexyl-nonane-1,1,1-triolate Openeye Name: 3-butyl-2,2-dihexyl-nonane-1,1,1-triolate CAS Name: 3-butyl-2,2-dihexylnonane-1,1,1-triolate IUPAC Name: 3-butyl-2,2-dihexylnonane-1,1,1-triolate Traditional Name: 3-butyl-2,2-dihexyl-nonane-1,1,1-triolate Formula: C25H49O3-3 MolecularWeight: 397.65476

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(CCCC)C(CCCCCC)(CCCCCC)C([O-])([O-])[O-]

Isomeric SMILES

CCCCCCC(CCCC)C(CCCCCC)(CCCCCC)C([O-])([O-])[O-]

InChI

InChI=1S/C25H49O3/c1-5-9-13-16-20-23(19-12-8-4)24(25(26,27)28,21-17-14-10-6-2)22-18-15-11-7-3/h23H,5-22H2,1-4H3/q-3