2-(2-bromanyl-6-chloranyl-4-methyl-phenoxy)-N-methyl-N-(phenylmethyl)ethanamine; ethanedioic acid

Systemtic Name: 2-(2-bromanyl-6-chloranyl-4-methyl-phenoxy)-N-methyl-N-(phenylmethyl)ethanamine; ethanedioic acid Openeye Name: N-benzyl-2-(2-bromo-6-chloro-4-methyl-phenoxy)-N-methyl-ethanamine; oxalic acid CAS Name: 2-(2-bromo-6-chloro-4-methylphenoxy)-N-methyl-N-(phenylmethyl)ethanamine; oxalic acid IUPAC Name: N-benzyl-2-(2-bromo-6-chloro-4-methylphenoxy)-N-methylethanamine; oxalic acid Traditional Name: benzyl-[2-(2-bromo-6-chloro-4-methyl-phenoxy)ethyl]-methyl-amine; oxalic acid Formula: C19H21BrClNO5 MolecularWeight: 458.73074

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)Br)OCCN(C)CC2=CC=CC=C2)Cl.C(=O)(C(=O)O)O

Isomeric SMILES

CC1=CC(=C(C(=C1)Br)OCCN(C)CC2=CC=CC=C2)Cl.C(=O)(C(=O)O)O

InChI

InChI=1S/C17H19BrClNO.C2H2O4/c1-13-10-15(18)17(16(19)11-13)21-9-8-20(2)12-14-6-4-3-5-7-14;3-1(4)2(5)6/h3-7,10-11H,8-9,12H2,1-2H3;(H,3,4)(H,5,6)