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aluminum; octadecanoate; octadecan-1-ol

aluminum; octadecanoate; octadecan-1-ol

Systemtic Name:aluminum; octadecanoate; octadecan-1-ol
Openeye Name:aluminum; octadecanoate; octadecan-1-ol
CAS Name:aluminum; octadecanoate; 1-octadecanol
IUPAC Name:aluminum; octadecanoate; octadecan-1-ol
Traditional Name:aluminum; octadecan-1-ol; stearate
Formula: C72H143AlO7
MolecularWeight: 1147.883158
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCO.CCCCCCCCCCCCCCCCCC(=O)[O-].CCCCCCCCCCCCCCCCCC(=O)[O-].CCCCCCCCCCCCCCCCCC(=O)[O-].[Al+3]


Isomeric SMILES

CCCCCCCCCCCCCCCCCCO.CCCCCCCCCCCCCCCCCC(=O)[O-].CCCCCCCCCCCCCCCCCC(=O)[O-].CCCCCCCCCCCCCCCCCC(=O)[O-].[Al+3]


InChI

InChI=1S/3C18H36O2.C18H38O.Al/c3*1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20;1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19;/h3*2-17H2,1H3,(H,19,20);19H,2-18H2,1H3;/q;;;;+3/p-3


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