3-(4-bromanyl-2-chloranyl-phenoxy)-N-methyl-propan-1-amine; ethanedioic acid

Systemtic Name: 3-(4-bromanyl-2-chloranyl-phenoxy)-N-methyl-propan-1-amine; ethanedioic acid Openeye Name: 3-(4-bromo-2-chloro-phenoxy)-N-methyl-propan-1-amine; oxalic acid CAS Name: 3-(4-bromo-2-chlorophenoxy)-N-methyl-1-propanamine; oxalic acid IUPAC Name: 3-(4-bromo-2-chlorophenoxy)-N-methylpropan-1-amine; oxalic acid Traditional Name: 3-(4-bromo-2-chloro-phenoxy)propyl-methyl-amine; oxalic acid Formula: C12H15BrClNO5 MolecularWeight: 368.6082

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Descriptors Computed from Structure

Canonical SMILES:

CNCCCOC1=C(C=C(C=C1)Br)Cl.C(=O)(C(=O)O)O

Isomeric SMILES

CNCCCOC1=C(C=C(C=C1)Br)Cl.C(=O)(C(=O)O)O

InChI

InChI=1S/C10H13BrClNO.C2H2O4/c1-13-5-2-6-14-10-4-3-8(11)7-9(10)12;3-1(4)2(5)6/h3-4,7,13H,2,5-6H2,1H3;(H,3,4)(H,5,6)