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aluminum 4-oxidanylidene-1H-quinoline-2-carboxylate

aluminum 4-oxidanylidene-1H-quinoline-2-carboxylate

Systemtic Name:aluminum 4-oxidanylidene-1H-quinoline-2-carboxylate
Openeye Name:aluminum 4-oxo-1H-quinoline-2-carboxylate
CAS Name:aluminum 4-oxo-1H-quinoline-2-carboxylate
IUPAC Name:aluminum 4-oxo-1H-quinoline-2-carboxylate
Traditional Name:aluminum 4-keto-1H-quinoline-2-carboxylate
Formula: C30H18AlN3O9
MolecularWeight: 591.460158
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/3C10H7NO3.Al/c3*12-9-5-8(10(13)14)11-7-4-2-1-3-6(7)9;/h3*1-5H,(H,11,12)(H,13,14);/q;;;+3/p-3


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