N-[2-[2-(4-bromanyl-2-chloranyl-phenoxy)ethoxy]ethyl]butan-2-amine; ethanedioic acid

Systemtic Name: N-[2-[2-(4-bromanyl-2-chloranyl-phenoxy)ethoxy]ethyl]butan-2-amine; ethanedioic acid Openeye Name: N-[2-[2-(4-bromo-2-chloro-phenoxy)ethoxy]ethyl]butan-2-amine; oxalic acid CAS Name: N-[2-[2-(4-bromo-2-chlorophenoxy)ethoxy]ethyl]-2-butanamine; oxalic acid IUPAC Name: N-[2-[2-(4-bromo-2-chlorophenoxy)ethoxy]ethyl]butan-2-amine; oxalic acid Traditional Name: 2-[2-(4-bromo-2-chloro-phenoxy)ethoxy]ethyl-sec-butyl-amine; oxalic acid Formula: C16H23BrClNO6 MolecularWeight: 440.71392

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NCCOCCOC1=C(C=C(C=C1)Br)Cl.C(=O)(C(=O)O)O

Isomeric SMILES

CCC(C)NCCOCCOC1=C(C=C(C=C1)Br)Cl.C(=O)(C(=O)O)O

InChI

InChI=1S/C14H21BrClNO2.C2H2O4/c1-3-11(2)17-6-7-18-8-9-19-14-5-4-12(15)10-13(14)16;3-1(4)2(5)6/h4-5,10-11,17H,3,6-9H2,1-2H3;(H,3,4)(H,5,6)