ethanedioic acid; 2-methyl-8-[3-(2,4,6-trimethylphenoxy)propoxy]quinoline

Systemtic Name: ethanedioic acid; 2-methyl-8-[3-(2,4,6-trimethylphenoxy)propoxy]quinoline Openeye Name: 2-methyl-8-[3-(2,4,6-trimethylphenoxy)propoxy]quinoline; oxalic acid CAS Name: 2-methyl-8-[3-(2,4,6-trimethylphenoxy)propoxy]quinoline; oxalic acid IUPAC Name: 2-methyl-8-[3-(2,4,6-trimethylphenoxy)propoxy]quinoline; oxalic acid Traditional Name: 2-methyl-8-[3-(2,4,6-trimethylphenoxy)propoxy]quinoline; oxalic acid Formula: C24H27NO6 MolecularWeight: 425.47428

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=CC=C2OCCCOC3=C(C=C(C=C3C)C)C)C=C1.C(=O)(C(=O)O)O

Isomeric SMILES

CC1=NC2=C(C=CC=C2OCCCOC3=C(C=C(C=C3C)C)C)C=C1.C(=O)(C(=O)O)O

InChI

InChI=1S/C22H25NO2.C2H2O4/c1-15-13-16(2)22(17(3)14-15)25-12-6-11-24-20-8-5-7-19-10-9-18(4)23-21(19)20;3-1(4)2(5)6/h5,7-10,13-14H,6,11-12H2,1-4H3;(H,3,4)(H,5,6)