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

Systemtic Name: 3-[[4-[[(2-chloranylpyridin-3-yl)carbonylhydrazinylidene]methyl]-2-methoxy-phenoxy]methyl]benzoic acid Openeye Name: 3-[[4-[[(2-chloropyridine-3-carbonyl)hydrazono]methyl]-2-methoxy-phenoxy]methyl]benzoic acid CAS Name: 3-[[4-[[[(2-chloro-3-pyridinyl)-oxomethyl]hydrazinylidene]methyl]-2-methoxyphenoxy]methyl]benzoic acid IUPAC Name: 3-[[4-[[(2-chloropyridine-3-carbonyl)hydrazinylidene]methyl]-2-methoxyphenoxy]methyl]benzoic acid Traditional Name: 3-[[4-[[(2-chloronicotinoyl)hydrazono]methyl]-2-methoxy-phenoxy]methyl]benzoic acid Formula: C22H18ClN3O5 MolecularWeight: 439.84842

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H18ClN3O5/c1-30-19-11-14(12-25-26-21(27)17-6-3-9-24-20(17)23)7-8-18(19)31-13-15-4-2-5-16(10-15)22(28)29/h2-12H,13H2,1H3,(H,26,27)(H,28,29)