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

Systemtic Name: 2-(2-bromanyl-4,6-dimethyl-phenoxy)-N-methyl-N-(phenylmethyl)ethanamine; ethanedioic acid Openeye Name: N-benzyl-2-(2-bromo-4,6-dimethyl-phenoxy)-N-methyl-ethanamine; oxalic acid CAS Name: 2-(2-bromo-4,6-dimethylphenoxy)-N-methyl-N-(phenylmethyl)ethanamine; oxalic acid IUPAC Name: N-benzyl-2-(2-bromo-4,6-dimethylphenoxy)-N-methylethanamine; oxalic acid Traditional Name: benzyl-[2-(2-bromo-4,6-dimethyl-phenoxy)ethyl]-methyl-amine; oxalic acid Formula: C20H24BrNO5 MolecularWeight: 438.31226

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H22BrNO.C2H2O4/c1-14-11-15(2)18(17(19)12-14)21-10-9-20(3)13-16-7-5-4-6-8-16;3-1(4)2(5)6/h4-8,11-12H,9-10,13H2,1-3H3;(H,3,4)(H,5,6)