Basic information
- Standard SMILES
CCOC(=O)C1(Cc2ccc(OC)c(OC)c2)C(=O)NCC1c1ccc2c(c1)OCO2- InChIKey
OPCJEPZNMHCXFP-UHFFFAOYSA-N- Molecular formula
- C23H25NO7
- Average molar mass
- 427.4 g/mol
Names & identifiers
- Preferred name
- Ethyl 3-(3,4-dimethoxybenzyl)-4-(3,4-methylenedioxyphenyl)-2-oxo-3-pyrrolidinecarboxylate
- IUPAC
- ethyl 4-(1,3-benzodioxol-5-yl)-3-[(3,4-dimethoxyphenyl)methyl]-2-oxopyrrolidine-3-carboxylate
Names & synonyms
SCHEMBL11860420OPCJEPZNMHCXFP-UHFFFAOYSA-Nethyl 3-(3,4-dimethoxybenzyl)-4-(3,4-methylenedioxyphenyl)-2-oxo-3-pyrrolidinecarboxylate
Database identifiers
- PubChem CID
- 13248014
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 92.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 8
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 658
Related reactions
2 records
Compound notes
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