4-[[4-[[(2-chloranylpyridin-3-yl)carbonylhydrazinylidene]methyl]-2-iodanyl-6-methoxy-phenoxy]methyl]benzoic acid

Systemtic Name: 4-[[4-[[(2-chloranylpyridin-3-yl)carbonylhydrazinylidene]methyl]-2-iodanyl-6-methoxy-phenoxy]methyl]benzoic acid Openeye Name: 4-[[4-[[(2-chloropyridine-3-carbonyl)hydrazono]methyl]-2-iodo-6-methoxy-phenoxy]methyl]benzoic acid CAS Name: 4-[[4-[[[(2-chloro-3-pyridinyl)-oxomethyl]hydrazinylidene]methyl]-2-iodo-6-methoxyphenoxy]methyl]benzoic acid IUPAC Name: 4-[[4-[[(2-chloropyridine-3-carbonyl)hydrazinylidene]methyl]-2-iodo-6-methoxyphenoxy]methyl]benzoic acid Traditional Name: 4-[[4-[[(2-chloronicotinoyl)hydrazono]methyl]-2-iodo-6-methoxy-phenoxy]methyl]benzoic acid Formula: C22H17ClIN3O5 MolecularWeight: 565.74495

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C=NNC(=O)C2=C(N=CC=C2)Cl)I)OCC3=CC=C(C=C3)C(=O)O

Isomeric SMILES

COC1=C(C(=CC(=C1)C=NNC(=O)C2=C(N=CC=C2)Cl)I)OCC3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C22H17ClIN3O5/c1-31-18-10-14(11-26-27-21(28)16-3-2-8-25-20(16)23)9-17(24)19(18)32-12-13-4-6-15(7-5-13)22(29)30/h2-11H,12H2,1H3,(H,27,28)(H,29,30)