aluminum 1-[(Z)-octadec-9-enoxy]-1-oxidanylidene-propan-2-olate

Systemtic Name: aluminum 1-[(Z)-octadec-9-enoxy]-1-oxidanylidene-propan-2-olate Openeye Name: aluminum 1-[(Z)-octadec-9-enoxy]-1-oxo-propan-2-olate CAS Name: aluminum 1-[(Z)-octadec-9-enoxy]-1-oxo-2-propanolate IUPAC Name: aluminum 1-[(Z)-octadec-9-enoxy]-1-oxopropan-2-olate Traditional Name: aluminum 1-keto-1-[(Z)-octadec-9-enoxy]propan-2-olate Formula: C63H117AlO9 MolecularWeight: 1045.579218

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCCOC(=O)C(C)[O-].CCCCCCCCC=CCCCCCCCCOC(=O)C(C)[O-].CCCCCCCCC=CCCCCCCCCOC(=O)C(C)[O-].[Al+3]

Isomeric SMILES

CCCCCCCC/C=C\CCCCCCCCOC(=O)C([O-])C.CCCCCCCC/C=C\CCCCCCCCOC(=O)C([O-])C.CCCCCCCC/C=C\CCCCCCCCOC(=O)C([O-])C.[Al+3]

InChI

InChI=1S/3C21H39O3.Al/c3*1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-24-21(23)20(2)22;/h3*10-11,20H,3-9,12-19H2,1-2H3;/q3*-1;+3/b3*11-10-;