Basic information
- Standard SMILES
CCc1c(Cl)nc(OCc2ccccc2)c(C(=O)OCc2ccccc2)c1OCc1ccccc1- InChIKey
IINBAFXWKBIVKR-UHFFFAOYSA-N- Molecular formula
- C29H26ClNO4
- Average molar mass
- 488 g/mol
Names & identifiers
- Preferred name
- Benzyl 2,4-bis(benzyloxy)-6-chloro-5-ethylnicotinate
- IUPAC
- benzyl 6-chloro-5-ethyl-2,4-bis(phenylmethoxy)pyridine-3-carboxylate
Names & synonyms
Benzyl 2,4-bis(benzyloxy)-6-chloro-5-ethylnicotinate1426530-29-1MFCD28134502benzyl 6-chloro-5-ethyl-2,4-bis(phenylmethoxy)pyridine-3-carboxylateC29H26ClNO4SCHEMBL14741244IINBAFXWKBIVKR-UHFFFAOYSA-Nbenzyl 2,4-bis(benzyloxy)-6-chloro-5-ethylpyridine-3-carboxylateAKOS024463517DS-7745SY116504A50834
Show more names
F819382Benzyl2,4-bis(benzyloxy)-6-chloro-5-ethylnicotinatebenzyl 2,4-dibenzyloxy-6-chloro-5-ethyl-pyridine-3-carboxylate
Database identifiers
- PubChem CID
- 86280413
Properties
Computed structural properties
- XLogP
- 7.2
- Topological polar surface area
- 57.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 11
- Heavy atoms
- 35
- Formal charge
- 0
- Complexity
- 616
Related reactions
3 records
Compound notes
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