Basic information
- Standard SMILES
CCOC(=O)/C=C/c1cn(Cc2ccc3cc(OCc4ccccc4)ccc3c2)cc1-c1ccccc1- InChIKey
UODCEQXAEINZJQ-FBMGVBCBSA-N- Molecular formula
- C33H29NO3
- Average molar mass
- 487.6 g/mol
- Monoisotopic mass
- 487.21474379
Names & identifiers
- Preferred name
- ethyl(E)-3-[1-(6-benzyloxy-2-naphthylmethyl)-4-phenyl-3-pyrrolyl]propenoate
- IUPAC
- ethyl (E)-3-[4-phenyl-1-[(6-phenylmethoxynaphthalen-2-yl)methyl]pyrrol-3-yl]prop-2-enoate
Names & synonyms
SCHEMBL5385296UODCEQXAEINZJQ-FBMGVBCBSA-Nethyl(E)-3-[1-(6-benzyloxy-2-naphthylmethyl)-4-phenyl-3-pyrrolyl]propenoate
Database identifiers
- PubChem CID
- 69423912
Properties
Computed structural properties
- XLogP
- 7.2
- Topological polar surface area
- 40.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 10
- Heavy atoms
- 37
- Formal charge
- 0
- Complexity
- 725
Related reactions
2 records
Compound notes
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