ethanedioic acid; N-[3-(4-iodanylphenoxy)propyl]butan-2-amine

Systemtic Name: ethanedioic acid; N-[3-(4-iodanylphenoxy)propyl]butan-2-amine Openeye Name: N-[3-(4-iodophenoxy)propyl]butan-2-amine; oxalic acid CAS Name: N-[3-(4-iodophenoxy)propyl]-2-butanamine; oxalic acid IUPAC Name: N-[3-(4-iodophenoxy)propyl]butan-2-amine; oxalic acid Traditional Name: 3-(4-iodophenoxy)propyl-sec-butyl-amine; oxalic acid Formula: C15H22INO5 MolecularWeight: 423.24335

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NCCCOC1=CC=C(C=C1)I.C(=O)(C(=O)O)O

Isomeric SMILES

CCC(C)NCCCOC1=CC=C(C=C1)I.C(=O)(C(=O)O)O

InChI

InChI=1S/C13H20INO.C2H2O4/c1-3-11(2)15-9-4-10-16-13-7-5-12(14)6-8-13;3-1(4)2(5)6/h5-8,11,15H,3-4,9-10H2,1-2H3;(H,3,4)(H,5,6)