2-Methoxy-4-(2-((4-nitrophenoxy)acetyl)carbohydrazonoyl)phenyl 4-butoxybenzoate
Basic information
- CAS
880047-16-5- Standard SMILES
CCCCOc1ccc(C(=O)Oc2ccc(/C=N/NC(=O)COc3ccc([N+](=O)[O-])cc3)cc2OC)cc1- InChIKey
KDDTXNUTBBAWMW-OGLMXYFKSA-N- Molecular formula
- C27H27N3O8
- Average molar mass
- 521.5 g/mol
- Monoisotopic mass
- 521.17981483
Names & identifiers
- Preferred name
- 2-Methoxy-4-(2-((4-nitrophenoxy)acetyl)carbohydrazonoyl)phenyl 4-butoxybenzoate
- IUPAC
- [2-methoxy-4-[(E)-[[2-(4-nitrophenoxy)acetyl]hydrazinylidene]methyl]phenyl] 4-butoxybenzoate
- English name
- 2-Methoxy-4-(2-((4-nitrophenoxy)acetyl)carbohydrazonoyl)phenyl 4-butoxybenzoate
- Molecular weight
- 0
Names & synonyms
AKOS0244021772-METHOXY-4-(2-((4-NITROPHENOXY)ACETYL)CARBOHYDRAZONOYL)PHENYL 4-BUTOXYBENZOATE
Database identifiers
- CAS
880047-16-5- PubChem CID
- 9645262
- EC Number
- 137-855-5
Properties
Computed structural properties
- XLogP
- 5.3
- Topological polar surface area
- 141 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 13
- Heavy atoms
- 38
- Formal charge
- 0
- Complexity
- 773
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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