Basic information
- Standard SMILES
COc1cc[nH]c1C=C1C(=O)Nc2cccc(-c3ccc(C(=O)O)cc3)c21- InChIKey
FRKQKPRADRVKBU-UHFFFAOYSA-N- Molecular formula
- C21H16N2O4
- Average molar mass
- 360.4 g/mol
- Monoisotopic mass
- 360.111007
Names & identifiers
- Preferred name
- 4-[3-[(3-methoxy-1H-pyrrol-2-yl)methylidene]-2-oxo-1H-indol-4-yl]benzoic acid
- IUPAC
- 4-[3-[(3-methoxy-1H-pyrrol-2-yl)methylidene]-2-oxo-1H-indol-4-yl]benzoic acid
Names & synonyms
SCHEMBL7819675
Database identifiers
- PubChem CID
- 53814569
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 91.4 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 611
Related reactions
1 records
Compound notes
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