octadecanoic acid; propan-2-ol; zirconium

Systemtic Name: octadecanoic acid; propan-2-ol; zirconium Openeye Name: propan-2-ol; stearic acid; zirconium CAS Name: octadecanoic acid; 2-propanol; zirconium IUPAC Name: octadecanoic acid; propan-2-ol; zirconium Traditional Name: propan-2-ol; stearic acid; zirconium Formula: C21H44O3Zr MolecularWeight: 435.79626

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)O.CC(C)O.[Zr]

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)O.CC(C)O.[Zr]

InChI

InChI=1S/C18H36O2.C3H8O.Zr/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20;1-3(2)4;/h2-17H2,1H3,(H,19,20);3-4H,1-2H3;