chromium(3+); 3,5-ditert-butyloctadecanoate

Systemtic Name: chromium(3+); 3,5-ditert-butyloctadecanoate Openeye Name: chromic 3,5-ditert-butyloctadecanoate CAS Name: chromium(3+); 3,5-ditert-butyloctadecanoate IUPAC Name: chromium(3+); 3,5-ditert-butyloctadecanoate Traditional Name: chromic 3,5-ditert-butylstearate Formula: C78H153CrO6 MolecularWeight: 1239.04192

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC(CC(CC(=O)[O-])C(C)(C)C)C(C)(C)C.CCCCCCCCCCCCCC(CC(CC(=O)[O-])C(C)(C)C)C(C)(C)C.CCCCCCCCCCCCCC(CC(CC(=O)[O-])C(C)(C)C)C(C)(C)C.[Cr+3]

Isomeric SMILES

CCCCCCCCCCCCCC(CC(CC(=O)[O-])C(C)(C)C)C(C)(C)C.CCCCCCCCCCCCCC(CC(CC(=O)[O-])C(C)(C)C)C(C)(C)C.CCCCCCCCCCCCCC(CC(CC(=O)[O-])C(C)(C)C)C(C)(C)C.[Cr+3]

InChI

InChI=1S/3C26H52O2.Cr/c3*1-8-9-10-11-12-13-14-15-16-17-18-19-22(25(2,3)4)20-23(21-24(27)28)26(5,6)7;/h3*22-23H,8-21H2,1-7H3,(H,27,28);/q;;;+3/p-3