ethyl 2-[2-(4-tert-butylphenyl)-6-iodanyl-imidazo[1,2-b]pyridazin-3-yl]-2-oxidanyl-ethanoate

Systemtic Name: ethyl 2-[2-(4-tert-butylphenyl)-6-iodanyl-imidazo[1,2-b]pyridazin-3-yl]-2-oxidanyl-ethanoate Openeye Name: ethyl 2-[2-(4-tert-butylphenyl)-6-iodo-imidazo[1,2-b]pyridazin-3-yl]-2-hydroxy-acetate CAS Name: 2-[2-(4-tert-butylphenyl)-6-iodo-3-imidazo[1,2-b]pyridazinyl]-2-hydroxyacetic acid ethyl ester IUPAC Name: ethyl 2-[2-(4-tert-butylphenyl)-6-iodoimidazo[1,2-b]pyridazin-3-yl]-2-hydroxyacetate Traditional Name: 2-[2-(4-tert-butylphenyl)-6-iodo-imidazo[1,2-b]pyridazin-3-yl]-2-hydroxy-acetic acid ethyl ester Formula: C20H22IN3O3 MolecularWeight: 479.31145

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C1=C(N=C2N1N=C(C=C2)I)C3=CC=C(C=C3)C(C)(C)C)O

Isomeric SMILES

CCOC(=O)C(C1=C(N=C2N1N=C(C=C2)I)C3=CC=C(C=C3)C(C)(C)C)O

InChI

InChI=1S/C20H22IN3O3/c1-5-27-19(26)18(25)17-16(22-15-11-10-14(21)23-24(15)17)12-6-8-13(9-7-12)20(2,3)4/h6-11,18,25H,5H2,1-4H3