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

Systemtic Name: 2-(4-bromanyl-2-chloranyl-phenoxy)-N-methyl-ethanamine; ethanedioic acid Openeye Name: 2-(4-bromo-2-chloro-phenoxy)-N-methyl-ethanamine; oxalic acid CAS Name: 2-(4-bromo-2-chlorophenoxy)-N-methylethanamine; oxalic acid IUPAC Name: 2-(4-bromo-2-chlorophenoxy)-N-methylethanamine; oxalic acid Traditional Name: 2-(4-bromo-2-chloro-phenoxy)ethyl-methyl-amine; oxalic acid Formula: C11H13BrClNO5 MolecularWeight: 354.58162

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Descriptors Computed from Structure

Canonical SMILES:

CNCCOC1=C(C=C(C=C1)Br)Cl.C(=O)(C(=O)O)O

Isomeric SMILES

CNCCOC1=C(C=C(C=C1)Br)Cl.C(=O)(C(=O)O)O

InChI

InChI=1S/C9H11BrClNO.C2H2O4/c1-12-4-5-13-9-3-2-7(10)6-8(9)11;3-1(4)2(5)6/h2-3,6,12H,4-5H2,1H3;(H,3,4)(H,5,6)