2-[2-bromanyl-4-[(Z)-(2-cyanoethanoylhydrazinylidene)methyl]-6-methoxy-phenoxy]ethanoic acid

Systemtic Name: 2-[2-bromanyl-4-[(Z)-(2-cyanoethanoylhydrazinylidene)methyl]-6-methoxy-phenoxy]ethanoic acid Openeye Name: 2-[2-bromo-4-[(Z)-[(2-cyanoacetyl)hydrazono]methyl]-6-methoxy-phenoxy]acetic acid CAS Name: 2-[2-bromo-4-[(Z)-[(2-cyano-1-oxoethyl)hydrazinylidene]methyl]-6-methoxyphenoxy]acetic acid IUPAC Name: 2-[2-bromo-4-[(Z)-[(2-cyanoacetyl)hydrazinylidene]methyl]-6-methoxyphenoxy]acetic acid Traditional Name: 2-[2-bromo-4-[(Z)-[(2-cyanoacetyl)hydrazono]methyl]-6-methoxy-phenoxy]acetic acid Formula: C13H12BrN3O5 MolecularWeight: 370.15548

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C=NNC(=O)CC#N)Br)OCC(=O)O

Isomeric SMILES

COC1=C(C(=CC(=C1)/C=N\NC(=O)CC#N)Br)OCC(=O)O

InChI

InChI=1S/C13H12BrN3O5/c1-21-10-5-8(6-16-17-11(18)2-3-15)4-9(14)13(10)22-7-12(19)20/h4-6H,2,7H2,1H3,(H,17,18)(H,19,20)/b16-6-