4-[[4-[(E)-(2-cyanoethanoylhydrazinylidene)methyl]-2-methoxy-phenoxy]methyl]benzoic acid

Systemtic Name: 4-[[4-[(E)-(2-cyanoethanoylhydrazinylidene)methyl]-2-methoxy-phenoxy]methyl]benzoic acid Openeye Name: 4-[[4-[(E)-[(2-cyanoacetyl)hydrazono]methyl]-2-methoxy-phenoxy]methyl]benzoic acid CAS Name: 4-[[4-[(E)-[(2-cyano-1-oxoethyl)hydrazinylidene]methyl]-2-methoxyphenoxy]methyl]benzoic acid IUPAC Name: 4-[[4-[(E)-[(2-cyanoacetyl)hydrazinylidene]methyl]-2-methoxyphenoxy]methyl]benzoic acid Traditional Name: 4-[[4-[(E)-[(2-cyanoacetyl)hydrazono]methyl]-2-methoxy-phenoxy]methyl]benzoic acid Formula: C19H17N3O5 MolecularWeight: 367.35538

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=NNC(=O)CC#N)OCC2=CC=C(C=C2)C(=O)O

Isomeric SMILES

COC1=C(C=CC(=C1)/C=N/NC(=O)CC#N)OCC2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C19H17N3O5/c1-26-17-10-14(11-21-22-18(23)8-9-20)4-7-16(17)27-12-13-2-5-15(6-3-13)19(24)25/h2-7,10-11H,8,12H2,1H3,(H,22,23)(H,24,25)/b21-11+