Basic information
- CAS
393855-47-5- Standard SMILES
O=C(Oc1ccccc1/C=N/NC(=O)C(O)(c1ccccc1)c1ccccc1)c1ccc([N+](=O)[O-])cc1- InChIKey
GWWYUYLTAWCXFM-VUTHCHCSSA-N- Molecular formula
- C28H21N3O6
- Average molar mass
- 495.5 g/mol
Names & identifiers
- Preferred name
- 2-{2-[Hydroxy(diphenyl)acetyl]carbohydrazonoyl}phenyl 4-nitrobenzoate
- IUPAC
- [2-[(E)-[(2-hydroxy-2,2-diphenylacetyl)hydrazinylidene]methyl]phenyl] 4-nitrobenzoate
- English name
- 2-{2-[hydroxy(diphenyl)acetyl]carbohydrazonoyl}phenyl 4-nitrobenzoate
- Molecular formula
- C28H21N3O6
- Molecular weight
- 495.48284
Names & synonyms
2-{2-[hydroxy(diphenyl)acetyl]carbohydrazonoyl}phenyl 4-nitrobenzoateAG-205/08222009[2-[(E)-[(2-hydroxy-2,2-diphenylacetyl)hydrazinylidene]methyl]phenyl] 4-nitrobenzoate
Database identifiers
- CAS
393855-47-5
Properties
Computed structural properties
- XLogP
- 4.9
- Topological polar surface area
- 134 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 8
- Heavy atoms
- 37
- Formal charge
- 0
- Complexity
- 789
Chemistry & industry
Suppliers1 total
SPECS[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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