aluminum tricyclohexylmethanolate

Systemtic Name: aluminum tricyclohexylmethanolate Openeye Name: aluminum tricyclohexylmethanolate CAS Name: aluminum tricyclohexylmethanolate IUPAC Name: aluminum tricyclohexylmethanolate Traditional Name: aluminum tricyclohexylmethanolate Formula: C57H99AlO3 MolecularWeight: 859.375698

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(C2CCCCC2)(C3CCCCC3)[O-].C1CCC(CC1)C(C2CCCCC2)(C3CCCCC3)[O-].C1CCC(CC1)C(C2CCCCC2)(C3CCCCC3)[O-].[Al+3]

Isomeric SMILES

C1CCC(CC1)C(C2CCCCC2)(C3CCCCC3)[O-].C1CCC(CC1)C(C2CCCCC2)(C3CCCCC3)[O-].C1CCC(CC1)C(C2CCCCC2)(C3CCCCC3)[O-].[Al+3]

InChI

InChI=1S/3C19H33O.Al/c3*20-19(16-10-4-1-5-11-16,17-12-6-2-7-13-17)18-14-8-3-9-15-18;/h3*16-18H,1-15H2;/q3*-1;+3