2-diethylaminoethyl 2-[3,5-bis(iodanyl)-4-(3-iodanyl-4-oxidanyl-phenoxy)phenyl]ethanoate

Systemtic Name: 2-diethylaminoethyl 2-[3,5-bis(iodanyl)-4-(3-iodanyl-4-oxidanyl-phenoxy)phenyl]ethanoate Openeye Name: 2-diethylaminoethyl 2-[4-(4-hydroxy-3-iodo-phenoxy)-3,5-diiodo-phenyl]acetate CAS Name: 2-[4-(4-hydroxy-3-iodophenoxy)-3,5-diiodophenyl]acetic acid 2-diethylaminoethyl ester IUPAC Name: 2-diethylaminoethyl 2-[4-(4-hydroxy-3-iodophenoxy)-3,5-diiodophenyl]acetate Traditional Name: 2-[4-(4-hydroxy-3-iodo-phenoxy)-3,5-diiodo-phenyl]acetic acid 2-diethylaminoethyl ester Formula: C20H22I3NO4 MolecularWeight: 721.10639

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCOC(=O)CC1=CC(=C(C(=C1)I)OC2=CC(=C(C=C2)O)I)I

Isomeric SMILES

CCN(CC)CCOC(=O)CC1=CC(=C(C(=C1)I)OC2=CC(=C(C=C2)O)I)I

InChI

InChI=1S/C20H22I3NO4/c1-3-24(4-2)7-8-27-19(26)11-13-9-16(22)20(17(23)10-13)28-14-5-6-18(25)15(21)12-14/h5-6,9-10,12,25H,3-4,7-8,11H2,1-2H3