1-[2-(4-bromanyl-2-chloranyl-phenoxy)ethylamino]propan-2-ol; ethanedioic acid

Systemtic Name: 1-[2-(4-bromanyl-2-chloranyl-phenoxy)ethylamino]propan-2-ol; ethanedioic acid Openeye Name: 1-[2-(4-bromo-2-chloro-phenoxy)ethylamino]propan-2-ol; oxalic acid CAS Name: 1-[2-(4-bromo-2-chlorophenoxy)ethylamino]-2-propanol; oxalic acid IUPAC Name: 1-[2-(4-bromo-2-chlorophenoxy)ethylamino]propan-2-ol; oxalic acid Traditional Name: 1-[2-(4-bromo-2-chloro-phenoxy)ethylamino]propan-2-ol; oxalic acid Formula: C13H17BrClNO6 MolecularWeight: 398.63418

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H15BrClNO2.C2H2O4/c1-8(15)7-14-4-5-16-11-3-2-9(12)6-10(11)13;3-1(4)2(5)6/h2-3,6,8,14-15H,4-5,7H2,1H3;(H,3,4)(H,5,6)