ethanedioic acid; 1-ethyl-4-[3-(4-iodanylphenoxy)propyl]piperazine

Systemtic Name: ethanedioic acid; 1-ethyl-4-[3-(4-iodanylphenoxy)propyl]piperazine Openeye Name: 1-ethyl-4-[3-(4-iodophenoxy)propyl]piperazine; oxalic acid CAS Name: 1-ethyl-4-[3-(4-iodophenoxy)propyl]piperazine; oxalic acid IUPAC Name: 1-ethyl-4-[3-(4-iodophenoxy)propyl]piperazine; oxalic acid Traditional Name: 1-ethyl-4-[3-(4-iodophenoxy)propyl]piperazine; oxalic acid Formula: C17H25IN2O5 MolecularWeight: 464.29527

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)CCCOC2=CC=C(C=C2)I.C(=O)(C(=O)O)O

Isomeric SMILES

CCN1CCN(CC1)CCCOC2=CC=C(C=C2)I.C(=O)(C(=O)O)O

InChI

InChI=1S/C15H23IN2O.C2H2O4/c1-2-17-9-11-18(12-10-17)8-3-13-19-15-6-4-14(16)5-7-15;3-1(4)2(5)6/h4-7H,2-3,8-13H2,1H3;(H,3,4)(H,5,6)