potassium; octadecanoate; octadecanoic acid; propane-1,2-diol

Systemtic Name: potassium; octadecanoate; octadecanoic acid; propane-1,2-diol Openeye Name: potassium; octadecanoate; propane-1,2-diol; stearic acid CAS Name: potassium; octadecanoate; octadecanoic acid; propane-1,2-diol IUPAC Name: potassium; octadecanoate; octadecanoic acid; propane-1,2-diol Traditional Name: potassium; propane-1,2-diol; stearate; stearic acid Formula: C39H78KO6- MolecularWeight: 682.13132

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)O.CCCCCCCCCCCCCCCCCC(=O)[O-].[CH2-]C(CO)O.[K+]

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)O.CCCCCCCCCCCCCCCCCC(=O)[O-].[CH2-]C(CO)O.[K+]

InChI

InChI=1S/2C18H36O2.C3H7O2.K/c2*1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20;1-3(5)2-4;/h2*2-17H2,1H3,(H,19,20);3-5H,1-2H2;/q;;-1;+1/p-1