N-[2-(2-bromanyl-6-chloranyl-4-methyl-phenoxy)ethyl]-2-methoxy-ethanamine; ethanedioic acid

Systemtic Name: N-[2-(2-bromanyl-6-chloranyl-4-methyl-phenoxy)ethyl]-2-methoxy-ethanamine; ethanedioic acid Openeye Name: N-[2-(2-bromo-6-chloro-4-methyl-phenoxy)ethyl]-2-methoxy-ethanamine; oxalic acid CAS Name: N-[2-(2-bromo-6-chloro-4-methylphenoxy)ethyl]-2-methoxyethanamine; oxalic acid IUPAC Name: N-[2-(2-bromo-6-chloro-4-methylphenoxy)ethyl]-2-methoxyethanamine; oxalic acid Traditional Name: 2-(2-bromo-6-chloro-4-methyl-phenoxy)ethyl-(2-methoxyethyl)amine; oxalic acid Formula: C14H19BrClNO6 MolecularWeight: 412.66076

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)Br)OCCNCCOC)Cl.C(=O)(C(=O)O)O

Isomeric SMILES

CC1=CC(=C(C(=C1)Br)OCCNCCOC)Cl.C(=O)(C(=O)O)O

InChI

InChI=1S/C12H17BrClNO2.C2H2O4/c1-9-7-10(13)12(11(14)8-9)17-6-4-15-3-5-16-2;3-1(4)2(5)6/h7-8,15H,3-6H2,1-2H3;(H,3,4)(H,5,6)