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

Systemtic Name: 8-[2-(2-bromanyl-4,6-dimethyl-phenoxy)ethoxy]-2-methyl-quinoline; ethanedioic acid Openeye Name: 8-[2-(2-bromo-4,6-dimethyl-phenoxy)ethoxy]-2-methyl-quinoline; oxalic acid CAS Name: 8-[2-(2-bromo-4,6-dimethylphenoxy)ethoxy]-2-methylquinoline; oxalic acid IUPAC Name: 8-[2-(2-bromo-4,6-dimethylphenoxy)ethoxy]-2-methylquinoline; oxalic acid Traditional Name: 8-[2-(2-bromo-4,6-dimethyl-phenoxy)ethoxy]-2-methyl-quinoline; oxalic acid Formula: C22H22BrNO6 MolecularWeight: 476.31718

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=CC=C2OCCOC3=C(C=C(C=C3Br)C)C)C=C1.C(=O)(C(=O)O)O

Isomeric SMILES

CC1=NC2=C(C=CC=C2OCCOC3=C(C=C(C=C3Br)C)C)C=C1.C(=O)(C(=O)O)O

InChI

InChI=1S/C20H20BrNO2.C2H2O4/c1-13-11-14(2)20(17(21)12-13)24-10-9-23-18-6-4-5-16-8-7-15(3)22-19(16)18;3-1(4)2(5)6/h4-8,11-12H,9-10H2,1-3H3;(H,3,4)(H,5,6)