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

Systemtic Name: 4-[[4-[[(2-chloranylpyridin-3-yl)carbonylhydrazinylidene]methyl]-2-ethoxy-phenoxy]methyl]benzoic acid Openeye Name: 4-[[4-[[(2-chloropyridine-3-carbonyl)hydrazono]methyl]-2-ethoxy-phenoxy]methyl]benzoic acid CAS Name: 4-[[4-[[[(2-chloro-3-pyridinyl)-oxomethyl]hydrazinylidene]methyl]-2-ethoxyphenoxy]methyl]benzoic acid IUPAC Name: 4-[[4-[[(2-chloropyridine-3-carbonyl)hydrazinylidene]methyl]-2-ethoxyphenoxy]methyl]benzoic acid Traditional Name: 4-[[4-[[(2-chloronicotinoyl)hydrazono]methyl]-2-ethoxy-phenoxy]methyl]benzoic acid Formula: C23H20ClN3O5 MolecularWeight: 453.875

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C=NNC(=O)C2=C(N=CC=C2)Cl)OCC3=CC=C(C=C3)C(=O)O

Isomeric SMILES

CCOC1=C(C=CC(=C1)C=NNC(=O)C2=C(N=CC=C2)Cl)OCC3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C23H20ClN3O5/c1-2-31-20-12-16(13-26-27-22(28)18-4-3-11-25-21(18)24)7-10-19(20)32-14-15-5-8-17(9-6-15)23(29)30/h3-13H,2,14H2,1H3,(H,27,28)(H,29,30)