8-[3-(4-bromanyl-2-chloranyl-phenoxy)propoxy]-2-methyl-quinoline; ethanedioic acid

Systemtic Name: 8-[3-(4-bromanyl-2-chloranyl-phenoxy)propoxy]-2-methyl-quinoline; ethanedioic acid Openeye Name: 8-[3-(4-bromo-2-chloro-phenoxy)propoxy]-2-methyl-quinoline; oxalic acid CAS Name: 8-[3-(4-bromo-2-chlorophenoxy)propoxy]-2-methylquinoline; oxalic acid IUPAC Name: 8-[3-(4-bromo-2-chlorophenoxy)propoxy]-2-methylquinoline; oxalic acid Traditional Name: 8-[3-(4-bromo-2-chloro-phenoxy)propoxy]-2-methyl-quinoline; oxalic acid Formula: C21H19BrClNO6 MolecularWeight: 496.73566

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=CC=C2OCCCOC3=C(C=C(C=C3)Br)Cl)C=C1.C(=O)(C(=O)O)O

Isomeric SMILES

CC1=NC2=C(C=CC=C2OCCCOC3=C(C=C(C=C3)Br)Cl)C=C1.C(=O)(C(=O)O)O

InChI

InChI=1S/C19H17BrClNO2.C2H2O4/c1-13-6-7-14-4-2-5-18(19(14)22-13)24-11-3-10-23-17-9-8-15(20)12-16(17)21;3-1(4)2(5)6/h2,4-9,12H,3,10-11H2,1H3;(H,3,4)(H,5,6)