[3-[(E)-[2-(3-chloranylphenoxy)ethanoylhydrazinylidene]methyl]phenyl] 4-nitrobenzoate

Systemtic Name: [3-[(E)-[2-(3-chloranylphenoxy)ethanoylhydrazinylidene]methyl]phenyl] 4-nitrobenzoate Openeye Name: [3-[(E)-[[2-(3-chlorophenoxy)acetyl]hydrazono]methyl]phenyl] 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid [3-[(E)-[[2-(3-chlorophenoxy)-1-oxoethyl]hydrazinylidene]methyl]phenyl] ester IUPAC Name: [3-[(E)-[[2-(3-chlorophenoxy)acetyl]hydrazinylidene]methyl]phenyl] 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid [3-[(E)-[[2-(3-chlorophenoxy)acetyl]hydrazono]methyl]phenyl] ester Formula: C22H16ClN3O6 MolecularWeight: 453.83194

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H16ClN3O6/c23-17-4-2-5-19(12-17)31-14-21(27)25-24-13-15-3-1-6-20(11-15)32-22(28)16-7-9-18(10-8-16)26(29)30/h1-13H,14H2,(H,25,27)/b24-13+