Basic information
- Standard SMILES
CCOC(=O)C(CCCC(C#N)(c1ccc(OC)c(OC)c1)C(C)C)N=Cc1ccc(OC)c(OC)c1- InChIKey
YLMLOPKERWRIHH-UHFFFAOYSA-N- Molecular formula
- C29H38N2O6
- Average molar mass
- 510.6 g/mol
- Monoisotopic mass
- 510.27298694
Names & identifiers
- Preferred name
- N-[1-carboethoxy-5-(3,4-dimethoxyphenyl)-5-cyano-5-(isopropyl)pentyl]iminomethyl-3,4-dimethoxybenzene
- IUPAC
- ethyl 6-cyano-6-(3,4-dimethoxyphenyl)-2-[(3,4-dimethoxyphenyl)methylideneamino]-7-methyloctanoate
Names & synonyms
YLMLOPKERWRIHH-UHFFFAOYSA-NN-[1-carboethoxy-5-(3,4-dimethoxyphenyl)-5-cyano-5-(isopropyl)pentyl]iminomethyl-3,4-dimethoxybenzene
Database identifiers
- PubChem CID
- 20202215
Properties
Computed structural properties
- XLogP
- 5.5
- Topological polar surface area
- 99.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 15
- Heavy atoms
- 37
- Formal charge
- 0
- Complexity
- 765
Related reactions
4 records
Compound notes
Loading…