[4-[(E)-(pyridin-3-ylcarbonylhydrazinylidene)methyl]phenyl] 3-nitrobenzoate

Systemtic Name: [4-[(E)-(pyridin-3-ylcarbonylhydrazinylidene)methyl]phenyl] 3-nitrobenzoate Openeye Name: [4-[(E)-(pyridine-3-carbonylhydrazono)methyl]phenyl] 3-nitrobenzoate CAS Name: 3-nitrobenzoic acid [4-[(E)-[[oxo(3-pyridinyl)methyl]hydrazinylidene]methyl]phenyl] ester IUPAC Name: [4-[(E)-(pyridine-3-carbonylhydrazinylidene)methyl]phenyl] 3-nitrobenzoate Traditional Name: 3-nitrobenzoic acid [4-[(E)-(nicotinoylhydrazono)methyl]phenyl] ester Formula: C20H14N4O5 MolecularWeight: 390.34896

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H14N4O5/c25-19(16-4-2-10-21-13-16)23-22-12-14-6-8-18(9-7-14)29-20(26)15-3-1-5-17(11-15)24(27)28/h1-13H,(H,23,25)/b22-12+