gallium quinoline-8-carboxylate

Systemtic Name: gallium quinoline-8-carboxylate Openeye Name: gallium quinoline-8-carboxylate CAS Name: gallium 8-quinolinecarboxylate IUPAC Name: gallium quinoline-8-carboxylate Traditional Name: gallium quinoline-8-carboxylate Formula: C30H18GaN3O6 MolecularWeight: 586.20342

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)C(=O)[O-])N=CC=C2.C1=CC2=C(C(=C1)C(=O)[O-])N=CC=C2.C1=CC2=C(C(=C1)C(=O)[O-])N=CC=C2.[Ga+3]

Isomeric SMILES

C1=CC2=C(C(=C1)C(=O)[O-])N=CC=C2.C1=CC2=C(C(=C1)C(=O)[O-])N=CC=C2.C1=CC2=C(C(=C1)C(=O)[O-])N=CC=C2.[Ga+3]

InChI

InChI=1S/3C10H7NO2.Ga/c3*12-10(13)8-5-1-3-7-4-2-6-11-9(7)8;/h3*1-6H,(H,12,13);/q;;;+3/p-3