[4-[(E)-[2-(4-nitrophenoxy)ethanoylhydrazinylidene]methyl]phenyl] 2-iodanylbenzoate

Systemtic Name: [4-[(E)-[2-(4-nitrophenoxy)ethanoylhydrazinylidene]methyl]phenyl] 2-iodanylbenzoate Openeye Name: [4-[(E)-[[2-(4-nitrophenoxy)acetyl]hydrazono]methyl]phenyl] 2-iodobenzoate CAS Name: 2-iodobenzoic acid [4-[(E)-[[2-(4-nitrophenoxy)-1-oxoethyl]hydrazinylidene]methyl]phenyl] ester IUPAC Name: [4-[(E)-[[2-(4-nitrophenoxy)acetyl]hydrazinylidene]methyl]phenyl] 2-iodobenzoate Traditional Name: 2-iodobenzoic acid [4-[(E)-[[2-(4-nitrophenoxy)acetyl]hydrazono]methyl]phenyl] ester Formula: C22H16IN3O6 MolecularWeight: 545.28341

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)OC2=CC=C(C=C2)C=NNC(=O)COC3=CC=C(C=C3)[N+](=O)[O-])I

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)OC2=CC=C(C=C2)/C=N/NC(=O)COC3=CC=C(C=C3)[N+](=O)[O-])I

InChI

InChI=1S/C22H16IN3O6/c23-20-4-2-1-3-19(20)22(28)32-18-9-5-15(6-10-18)13-24-25-21(27)14-31-17-11-7-16(8-12-17)26(29)30/h1-13H,14H2,(H,25,27)/b24-13+