[4-[(E)-[(4-cyanophenyl)carbonylhydrazinylidene]methyl]phenyl] 4-nitrobenzoate

Systemtic Name: [4-[(E)-[(4-cyanophenyl)carbonylhydrazinylidene]methyl]phenyl] 4-nitrobenzoate Openeye Name: [4-[(E)-[(4-cyanobenzoyl)hydrazono]methyl]phenyl] 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid [4-[(E)-[[(4-cyanophenyl)-oxomethyl]hydrazinylidene]methyl]phenyl] ester IUPAC Name: [4-[(E)-[(4-cyanobenzoyl)hydrazinylidene]methyl]phenyl] 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid [4-[(E)-[(4-cyanobenzoyl)hydrazono]methyl]phenyl] ester Formula: C22H14N4O5 MolecularWeight: 414.37036

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C=NNC(=O)C2=CC=C(C=C2)C#N)OC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C22H14N4O5/c23-13-15-1-5-17(6-2-15)21(27)25-24-14-16-3-11-20(12-4-16)31-22(28)18-7-9-19(10-8-18)26(29)30/h1-12,14H,(H,25,27)/b24-14+