magnesium 10-oxidanylidene-1-phenyl-cyclooctadecan-1-olate bromide

Systemtic Name: magnesium 10-oxidanylidene-1-phenyl-cyclooctadecan-1-olate bromide Openeye Name: magnesium 10-oxo-1-phenyl-cyclooctadecanolate bromide CAS Name: magnesium 10-oxo-1-phenyl-1-cyclooctadecanolate bromide IUPAC Name: magnesium 10-oxo-1-phenylcyclooctadecan-1-olate bromide Traditional Name: magnesium 10-keto-1-phenyl-cyclooctadecanolate bromide Formula: C24H37BrMgO2 MolecularWeight: 461.75838

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCCC(CCCCCCCCC(=O)CCC1)(C2=CC=CC=C2)[O-].[Mg+2].[Br-]

Isomeric SMILES

C1CCCCC(CCCCCCCCC(=O)CCC1)(C2=CC=CC=C2)[O-].[Mg+2].[Br-]

InChI

InChI=1S/C24H37O2.BrH.Mg/c25-23-18-12-5-1-3-7-14-20-24(26,22-16-10-9-11-17-22)21-15-8-4-2-6-13-19-23;;/h9-11,16-17H,1-8,12-15,18-21H2;1H;/q-1;;+2/p-1