gallium 2-methylnaphthalene-1-carboxylate

Systemtic Name: gallium 2-methylnaphthalene-1-carboxylate Openeye Name: gallium 2-methylnaphthalene-1-carboxylate CAS Name: gallium 2-methyl-1-naphthalenecarboxylate IUPAC Name: gallium 2-methylnaphthalene-1-carboxylate Traditional Name: gallium 2-methyl-1-naphthoate Formula: C36H27GaO6 MolecularWeight: 625.31898

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2C=C1)C(=O)[O-].CC1=C(C2=CC=CC=C2C=C1)C(=O)[O-].CC1=C(C2=CC=CC=C2C=C1)C(=O)[O-].[Ga+3]

Isomeric SMILES

CC1=C(C2=CC=CC=C2C=C1)C(=O)[O-].CC1=C(C2=CC=CC=C2C=C1)C(=O)[O-].CC1=C(C2=CC=CC=C2C=C1)C(=O)[O-].[Ga+3]

InChI

InChI=1S/3C12H10O2.Ga/c3*1-8-6-7-9-4-2-3-5-10(9)11(8)12(13)14;/h3*2-7H,1H3,(H,13,14);/q;;;+3/p-3