aluminum 5-chloranylnaphthalene-1-carboxylate

Systemtic Name: aluminum 5-chloranylnaphthalene-1-carboxylate Openeye Name: aluminum 5-chloronaphthalene-1-carboxylate CAS Name: aluminum 5-chloro-1-naphthalenecarboxylate IUPAC Name: aluminum 5-chloronaphthalene-1-carboxylate Traditional Name: aluminum 5-chloro-1-naphthoate Formula: C33H18AlCl3O6 MolecularWeight: 643.832958

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CC=C2Cl)C(=C1)C(=O)[O-].C1=CC2=C(C=CC=C2Cl)C(=C1)C(=O)[O-].C1=CC2=C(C=CC=C2Cl)C(=C1)C(=O)[O-].[Al+3]

Isomeric SMILES

C1=CC2=C(C=CC=C2Cl)C(=C1)C(=O)[O-].C1=CC2=C(C=CC=C2Cl)C(=C1)C(=O)[O-].C1=CC2=C(C=CC=C2Cl)C(=C1)C(=O)[O-].[Al+3]

InChI

InChI=1S/3C11H7ClO2.Al/c3*12-10-6-2-3-7-8(10)4-1-5-9(7)11(13)14;/h3*1-6H,(H,13,14);/q;;;+3/p-3