4-[(E)-{2-[(4-methylphenoxy)acetyl]hydrazinylidene}methyl]phenyl 2-chlorobenzoate
Basic information
- CAS
364738-98-7- Standard SMILES
Cc1ccc(OCC(=O)N/N=C/c2ccc(OC(=O)c3ccccc3Cl)cc2)cc1- InChIKey
ZCTFGYYDVVZGDF-AFUMVMLFSA-N- Molecular formula
- C23H19ClN2O4
- Average molar mass
- 422.9 g/mol
- Monoisotopic mass
- 422.1033348
Names & identifiers
- Preferred name
- 4-[(E)-{2-[(4-methylphenoxy)acetyl]hydrazinylidene}methyl]phenyl 2-chlorobenzoate
- IUPAC
- [4-[(E)-[[2-(4-methylphenoxy)acetyl]hydrazinylidene]methyl]phenyl] 2-chlorobenzoate
Names & synonyms
MFCD00341942STK070908ZINC33345549AKOS000517411ZINC000000919032O=C(COc1ccc(cc1)C)NN=Cc1ccc(cc1)OC(=O)c1ccccc1Cl2CHLOROBENZOICACID4((2PTOLYLOXYACETYL)HYDRAZONOMETHYL)PHENYLESTERCC1=CC=C(C=C1)OCC(=O)NN=CC2=CC=C(C=C2)OC(=O)C3=CC=CC=C3Cl(4((E)((2(4methylphenoxy)acetyl)hydrazinylidene)methyl)phenyl)2chlorobenzoate4((E)(2((4METHYLPHENOXY)ACETYL)HYDRAZINYLIDENE)METHYL)PHENYL2CHLOROBENZOATE4-(2-((4-METHYLPHENOXY)ACETYL)CARBOHYDRAZONOYL)PHENYL 2-CHLOROBENZOATE
Database identifiers
- CAS
364738-98-7- PubChem CID
- 9558488
- EC Number
- 120-138-6
Properties
Computed structural properties
- XLogP
- 5.3
- Topological polar surface area
- 77 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 8
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 584
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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