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

Systemtic Name: ethanedioic acid; 1-ethyl-4-[4-(4-iodanylphenoxy)butyl]piperazine Openeye Name: 1-ethyl-4-[4-(4-iodophenoxy)butyl]piperazine; oxalic acid CAS Name: 1-ethyl-4-[4-(4-iodophenoxy)butyl]piperazine; oxalic acid IUPAC Name: 1-ethyl-4-[4-(4-iodophenoxy)butyl]piperazine; oxalic acid Traditional Name: 1-ethyl-4-[4-(4-iodophenoxy)butyl]piperazine; oxalic acid Formula: C18H27IN2O5 MolecularWeight: 478.32185

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)CCCCOC2=CC=C(C=C2)I.C(=O)(C(=O)O)O

Isomeric SMILES

CCN1CCN(CC1)CCCCOC2=CC=C(C=C2)I.C(=O)(C(=O)O)O

InChI

InChI=1S/C16H25IN2O.C2H2O4/c1-2-18-10-12-19(13-11-18)9-3-4-14-20-16-7-5-15(17)6-8-16;3-1(4)2(5)6/h5-8H,2-4,9-14H2,1H3;(H,3,4)(H,5,6)