ethanedioic acid; 2-methyl-8-[2-(2,4,6-trimethylphenoxy)ethoxy]quinoline

Systemtic Name: ethanedioic acid; 2-methyl-8-[2-(2,4,6-trimethylphenoxy)ethoxy]quinoline Openeye Name: 2-methyl-8-[2-(2,4,6-trimethylphenoxy)ethoxy]quinoline; oxalic acid CAS Name: 2-methyl-8-[2-(2,4,6-trimethylphenoxy)ethoxy]quinoline; oxalic acid IUPAC Name: 2-methyl-8-[2-(2,4,6-trimethylphenoxy)ethoxy]quinoline; oxalic acid Traditional Name: 2-methyl-8-[2-(2,4,6-trimethylphenoxy)ethoxy]quinoline; oxalic acid Formula: C23H25NO6 MolecularWeight: 411.4477

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=CC=C2OCCOC3=C(C=C(C=C3C)C)C)C=C1.C(=O)(C(=O)O)O

Isomeric SMILES

CC1=NC2=C(C=CC=C2OCCOC3=C(C=C(C=C3C)C)C)C=C1.C(=O)(C(=O)O)O

InChI

InChI=1S/C21H23NO2.C2H2O4/c1-14-12-15(2)21(16(3)13-14)24-11-10-23-19-7-5-6-18-9-8-17(4)22-20(18)19;3-1(4)2(5)6/h5-9,12-13H,10-11H2,1-4H3;(H,3,4)(H,5,6)