2,2-bis(hydroxymethyl)propane-1,3-diol; butanoic acid; heptanoic acid

Systemtic Name: 2,2-bis(hydroxymethyl)propane-1,3-diol; butanoic acid; heptanoic acid Openeye Name: 2,2-bis(hydroxymethyl)propane-1,3-diol; butyric acid; heptanoic acid CAS Name: 2,2-bis(hydroxymethyl)propane-1,3-diol; butanoic acid; heptanoic acid IUPAC Name: 2,2-bis(hydroxymethyl)propane-1,3-diol; butanoic acid; heptanoic acid Traditional Name: butyric acid; 2,2-dimethylolpropane-1,3-diol; enanthic acid Formula: C16H34O8 MolecularWeight: 354.43636

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(=O)O.CCCC(=O)O.C(C(CO)(CO)CO)O

Isomeric SMILES

CCCCCCC(=O)O.CCCC(=O)O.C(C(CO)(CO)CO)O

InChI

InChI=1S/C7H14O2.C5H12O4.C4H8O2/c1-2-3-4-5-6-7(8)9;6-1-5(2-7,3-8)4-9;1-2-3-4(5)6/h2-6H2,1H3,(H,8,9);6-9H,1-4H2;2-3H2,1H3,(H,5,6)