4-[[2-iodanyl-4-[[(2-methylphenyl)carbamoylhydrazinylidene]methyl]phenoxy]methyl]benzoic acid

Systemtic Name: 4-[[2-iodanyl-4-[[(2-methylphenyl)carbamoylhydrazinylidene]methyl]phenoxy]methyl]benzoic acid Openeye Name: 4-[[2-iodo-4-[(o-tolylcarbamoylhydrazono)methyl]phenoxy]methyl]benzoic acid CAS Name: 4-[[2-iodo-4-[[[(2-methylanilino)-oxomethyl]hydrazinylidene]methyl]phenoxy]methyl]benzoic acid IUPAC Name: 4-[[2-iodo-4-[[(2-methylphenyl)carbamoylhydrazinylidene]methyl]phenoxy]methyl]benzoic acid Traditional Name: 4-[[2-iodo-4-[(o-tolylcarbamoylhydrazono)methyl]phenoxy]methyl]benzoic acid Formula: C23H20IN3O4 MolecularWeight: 529.32707

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)NN=CC2=CC(=C(C=C2)OCC3=CC=C(C=C3)C(=O)O)I

Isomeric SMILES

CC1=CC=CC=C1NC(=O)NN=CC2=CC(=C(C=C2)OCC3=CC=C(C=C3)C(=O)O)I

InChI

InChI=1S/C23H20IN3O4/c1-15-4-2-3-5-20(15)26-23(30)27-25-13-17-8-11-21(19(24)12-17)31-14-16-6-9-18(10-7-16)22(28)29/h2-13H,14H2,1H3,(H,28,29)(H2,26,27,30)