Basic information
- Standard SMILES
O=C(Nc1cccc(O)c1)c1ccc(C(=O)O)c(Cl)c1- InChIKey
BUJXUGAGJFOANU-UHFFFAOYSA-N- Molecular formula
- C14H10ClNO4
- Average molar mass
- 291.68 g/mol
- Monoisotopic mass
- 291.0298355
Names & identifiers
- Preferred name
- 2-Chloro-4-[[(3-hydroxyphenyl)amino]carbonyl]benzoic acid
- IUPAC
- 2-chloro-4-[(3-hydroxyphenyl)carbamoyl]benzoic acid
Names & synonyms
SCHEMBL6638444BUJXUGAGJFOANU-UHFFFAOYSA-N2-chloro-4-[[(3-hydroxyphenyl)amino]carbonyl]benzoic acid
Database identifiers
- PubChem CID
- 21999334
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 86.6 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 376
Related reactions
3 records
Compound notes
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