bis[(2-methylquinolin-8-yl)oxy]gallanyl 4-bis[(2-methylquinolin-8-yl)oxy]gallanyloxypent-4-en-2-ynoate

Systemtic Name: bis[(2-methylquinolin-8-yl)oxy]gallanyl 4-bis[(2-methylquinolin-8-yl)oxy]gallanyloxypent-4-en-2-ynoate Openeye Name: bis[(2-methyl-8-quinolyl)oxy]gallanyl 4-[bis[(2-methyl-8-quinolyl)oxy]gallanyloxy]pent-4-en-2-ynoate CAS Name: 4-[bis[(2-methyl-8-quinolinyl)oxy]gallanyloxy]pent-4-en-2-ynoic acid bis[(2-methyl-8-quinolinyl)oxy]gallanyl ester IUPAC Name: bis[(2-methylquinolin-8-yl)oxy]gallanyl 4-bis[(2-methylquinolin-8-yl)oxy]gallanyloxypent-4-en-2-ynoate Traditional Name: 4-[bis[(2-methyl-8-quinolyl)oxy]gallanyloxy]pent-4-en-2-ynoic acid bis[(2-methyl-8-quinolyl)oxy]gallanyl ester Formula: C45H34Ga2N4O7 MolecularWeight: 882.22006

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=CC=C2O[Ga](OC3=CC=CC4=C3N=C(C=C4)C)OC(=C)C#CC(=O)O[Ga](OC5=CC=CC6=C5N=C(C=C6)C)OC7=CC=CC8=C7N=C(C=C8)C)C=C1

Isomeric SMILES

CC1=NC2=C(C=CC=C2O[Ga](OC3=CC=CC4=C3N=C(C=C4)C)OC(=C)C#CC(=O)O[Ga](OC5=CC=CC6=C5N=C(C=C6)C)OC7=CC=CC8=C7N=C(C=C8)C)C=C1

InChI

InChI=1S/4C10H9NO.C5H4O3.2Ga/c4*1-7-5-6-8-3-2-4-9(12)10(8)11-7;1-4(6)2-3-5(7)8;;/h4*2-6,12H,1H3;6H,1H2,(H,7,8);;/q;;;;;2*+3/p-6