2-[4-[(E)-[2-[2-(4-azanyl-1,2,5-oxadiazol-3-yl)benzimidazol-1-yl]ethanoylhydrazinylidene]methyl]-2-methoxy-phenoxy]ethanoic acid

Systemtic Name: 2-[4-[(E)-[2-[2-(4-azanyl-1,2,5-oxadiazol-3-yl)benzimidazol-1-yl]ethanoylhydrazinylidene]methyl]-2-methoxy-phenoxy]ethanoic acid Openeye Name: 2-[4-[(E)-[[2-[2-(4-amino-1,2,5-oxadiazol-3-yl)benzimidazol-1-yl]acetyl]hydrazono]methyl]-2-methoxy-phenoxy]acetic acid CAS Name: 2-[4-[(E)-[[2-[2-(4-amino-1,2,5-oxadiazol-3-yl)-1-benzimidazolyl]-1-oxoethyl]hydrazinylidene]methyl]-2-methoxyphenoxy]acetic acid IUPAC Name: 2-[4-[(E)-[[2-[2-(4-amino-1,2,5-oxadiazol-3-yl)benzimidazol-1-yl]acetyl]hydrazinylidene]methyl]-2-methoxyphenoxy]acetic acid Traditional Name: 2-[4-[(E)-[[2-[2-(4-aminofurazan-3-yl)benzimidazol-1-yl]acetyl]hydrazono]methyl]-2-methoxy-phenoxy]acetic acid Formula: C21H19N7O6 MolecularWeight: 465.41886

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=NNC(=O)CN2C3=CC=CC=C3N=C2C4=NON=C4N)OCC(=O)O

Isomeric SMILES

COC1=C(C=CC(=C1)/C=N/NC(=O)CN2C3=CC=CC=C3N=C2C4=NON=C4N)OCC(=O)O

InChI

InChI=1S/C21H19N7O6/c1-32-16-8-12(6-7-15(16)33-11-18(30)31)9-23-25-17(29)10-28-14-5-3-2-4-13(14)24-21(28)19-20(22)27-34-26-19/h2-9H,10-11H2,1H3,(H2,22,27)(H,25,29)(H,30,31)/b23-9+