aluminum 2-(5H-chromeno[2,3-b]pyridin-7-yl)propanoate

Systemtic Name: aluminum 2-(5H-chromeno[2,3-b]pyridin-7-yl)propanoate Openeye Name: aluminum 2-(5H-chromeno[2,3-b]pyridin-7-yl)propanoate CAS Name: aluminum 2-(5H-[1]benzopyrano[2,3-b]pyridin-7-yl)propanoate IUPAC Name: aluminum 2-(5H-chromeno[2,3-b]pyridin-7-yl)propanoate Traditional Name: aluminum 2-(5H-chromeno[2,3-b]pyridin-7-yl)propionate Formula: C45H36AlN3O9 MolecularWeight: 789.763578

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=C(C=C1)OC3=C(C2)C=CC=N3)C(=O)[O-].CC(C1=CC2=C(C=C1)OC3=C(C2)C=CC=N3)C(=O)[O-].CC(C1=CC2=C(C=C1)OC3=C(C2)C=CC=N3)C(=O)[O-].[Al+3]

Isomeric SMILES

CC(C1=CC2=C(C=C1)OC3=C(C2)C=CC=N3)C(=O)[O-].CC(C1=CC2=C(C=C1)OC3=C(C2)C=CC=N3)C(=O)[O-].CC(C1=CC2=C(C=C1)OC3=C(C2)C=CC=N3)C(=O)[O-].[Al+3]

InChI

InChI=1S/3C15H13NO3.Al/c3*1-9(15(17)18)10-4-5-13-12(7-10)8-11-3-2-6-16-14(11)19-13;/h3*2-7,9H,8H2,1H3,(H,17,18);/q;;;+3/p-3