aluminum propan-2-olate dibenzoate

Systemtic Name: aluminum propan-2-olate dibenzoate Openeye Name: aluminum propan-2-olate dibenzoate CAS Name: aluminum 2-propanolate dibenzoate IUPAC Name: aluminum propan-2-olate dibenzoate Traditional Name: aluminum propan-2-olate dibenzoate Formula: C17H17AlO5 MolecularWeight: 328.295418

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[O-].C1=CC=C(C=C1)C(=O)[O-].C1=CC=C(C=C1)C(=O)[O-].[Al+3]

Isomeric SMILES

CC(C)[O-].C1=CC=C(C=C1)C(=O)[O-].C1=CC=C(C=C1)C(=O)[O-].[Al+3]

InChI

InChI=1S/2C7H6O2.C3H7O.Al/c2*8-7(9)6-4-2-1-3-5-6;1-3(2)4;/h2*1-5H,(H,8,9);3H,1-2H3;/q;;-1;+3/p-2