aluminum 2-[4-[2,2-bis(chloranyl)ethenyl]phenyl]propanoate

Systemtic Name: aluminum 2-[4-[2,2-bis(chloranyl)ethenyl]phenyl]propanoate Openeye Name: aluminum 2-[4-(2,2-dichlorovinyl)phenyl]propanoate CAS Name: aluminum 2-[4-(2,2-dichloroethenyl)phenyl]propanoate IUPAC Name: aluminum 2-[4-(2,2-dichloroethenyl)phenyl]propanoate Traditional Name: aluminum 2-[4-(2,2-dichlorovinyl)phenyl]propionate Formula: C33H27AlCl6O6 MolecularWeight: 759.263418

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/3C11H10Cl2O2.Al/c3*1-7(11(14)15)9-4-2-8(3-5-9)6-10(12)13;/h3*2-7H,1H3,(H,14,15);/q;;;+3/p-3