1-[8-[[7-(5-ethylnonan-2-yl)quinolin-8-yl]oxy-quinolin-8-yloxy-gallanyl]oxyquinolin-4-yl]hexan-1-one

Systemtic Name: 1-[8-[[7-(5-ethylnonan-2-yl)quinolin-8-yl]oxy-quinolin-8-yloxy-gallanyl]oxyquinolin-4-yl]hexan-1-one Openeye Name: 1-[8-[[7-(4-ethyl-1-methyl-octyl)-8-quinolyl]oxy-(8-quinolyloxy)gallanyl]oxy-4-quinolyl]hexan-1-one CAS Name: 1-[8-[[7-(5-ethylnonan-2-yl)-8-quinolinyl]oxy-(8-quinolinyloxy)gallanyl]oxy-4-quinolinyl]-1-hexanone IUPAC Name: 1-[8-[[7-(5-ethylnonan-2-yl)quinolin-8-yl]oxy-quinolin-8-yloxygallanyl]oxyquinolin-4-yl]hexan-1-one Traditional Name: 1-[8-[[7-(4-ethyl-1-methyl-octyl)-8-quinolyl]oxy-(8-quinolyloxy)gallanyl]oxy-4-quinolyl]hexan-1-one Formula: C44H50GaN3O4 MolecularWeight: 754.6085

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)C1=C2C=CC=C(C2=NC=C1)O[Ga](OC3=CC=CC4=C3N=CC=C4)OC5=C(C=CC6=C5N=CC=C6)C(C)CCC(CC)CCCC

Isomeric SMILES

CCCCCC(=O)C1=C2C=CC=C(C2=NC=C1)O[Ga](OC3=CC=CC4=C3N=CC=C4)OC5=C(C=CC6=C5N=CC=C6)C(C)CCC(CC)CCCC

InChI

InChI=1S/C20H29NO.C15H17NO2.C9H7NO.Ga/c1-4-6-8-16(5-2)11-10-15(3)18-13-12-17-9-7-14-21-19(17)20(18)22;1-2-3-4-7-13(17)11-9-10-16-15-12(11)6-5-8-14(15)18;11-8-5-1-3-7-4-2-6-10-9(7)8;/h7,9,12-16,22H,4-6,8,10-11H2,1-3H3;5-6,8-10,18H,2-4,7H2,1H3;1-6,11H;/q;;;+3/p-3