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

Systemtic Name: 2,2-bis(hydroxymethyl)propane-1,3-diol; heptanoic acid; octadecanoic acid Openeye Name: 2,2-bis(hydroxymethyl)propane-1,3-diol; heptanoic acid; stearic acid CAS Name: 2,2-bis(hydroxymethyl)propane-1,3-diol; heptanoic acid; octadecanoic acid IUPAC Name: 2,2-bis(hydroxymethyl)propane-1,3-diol; heptanoic acid; octadecanoic acid Traditional Name: 2,2-dimethylolpropane-1,3-diol; enanthic acid; stearic acid Formula: C30H62O8 MolecularWeight: 550.80848

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H36O2.C7H14O2.C5H12O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20;1-2-3-4-5-6-7(8)9;6-1-5(2-7,3-8)4-9/h2-17H2,1H3,(H,19,20);2-6H2,1H3,(H,8,9);6-9H,1-4H2