4-(4-butoxyphenoxy)-3,5-bis(iodanyl)benzoic acid

Systemtic Name: 4-(4-butoxyphenoxy)-3,5-bis(iodanyl)benzoic acid Openeye Name: 4-(4-butoxyphenoxy)-3,5-diiodo-benzoic acid CAS Name: 4-(4-butoxyphenoxy)-3,5-diiodobenzoic acid IUPAC Name: 4-(4-butoxyphenoxy)-3,5-diiodobenzoic acid Traditional Name: 4-(4-butoxyphenoxy)-3,5-diiodo-benzoic acid Formula: C17H16I2O4 MolecularWeight: 538.11548

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)OC2=C(C=C(C=C2I)C(=O)O)I

Isomeric SMILES

CCCCOC1=CC=C(C=C1)OC2=C(C=C(C=C2I)C(=O)O)I

InChI

InChI=1S/C17H16I2O4/c1-2-3-8-22-12-4-6-13(7-5-12)23-16-14(18)9-11(17(20)21)10-15(16)19/h4-7,9-10H,2-3,8H2,1H3,(H,20,21)