Basic information
- Standard SMILES
O=C(NC(Cc1ccc(OC(=O)c2ccccc2)c(OC(=O)c2ccccc2)c1)C(=O)O)c1ccccc1- InChIKey
JFOTXSBDACMHJU-UHFFFAOYSA-N- Molecular formula
- C30H23NO7
- Average molar mass
- 509.5 g/mol
Names & identifiers
- Preferred name
- 2-(Benzoylamino)-3-(3,4-dibenzoyloxyphenyl)propanoic acid
- IUPAC
- 2-benzamido-3-(3,4-dibenzoyloxyphenyl)propanoic acid
Names & synonyms
SCHEMBL10807099JFOTXSBDACMHJU-UHFFFAOYSA-N2-(benzoylamino)-3-(3,4-dibenzoyloxyphenyl)propanoic acid
Database identifiers
- PubChem CID
- 20205909
Properties
Computed structural properties
- XLogP
- 5.6
- Topological polar surface area
- 119 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 11
- Heavy atoms
- 38
- Formal charge
- 0
- Complexity
- 811
Related reactions
1 records
Compound notes
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