aluminum quinoxaline-2-carboxylate

Systemtic Name: aluminum quinoxaline-2-carboxylate Openeye Name: aluminum quinoxaline-2-carboxylate CAS Name: aluminum 2-quinoxalinecarboxylate IUPAC Name: aluminum quinoxaline-2-carboxylate Traditional Name: aluminum quinoxaline-2-carboxylate Formula: C27H15AlN6O6 MolecularWeight: 546.426138

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=CC(=N2)C(=O)[O-].C1=CC=C2C(=C1)N=CC(=N2)C(=O)[O-].C1=CC=C2C(=C1)N=CC(=N2)C(=O)[O-].[Al+3]

Isomeric SMILES

C1=CC=C2C(=C1)N=CC(=N2)C(=O)[O-].C1=CC=C2C(=C1)N=CC(=N2)C(=O)[O-].C1=CC=C2C(=C1)N=CC(=N2)C(=O)[O-].[Al+3]

InChI

InChI=1S/3C9H6N2O2.Al/c3*12-9(13)8-5-10-6-3-1-2-4-7(6)11-8;/h3*1-5H,(H,12,13);/q;;;+3/p-3