2-Benzoylamino-succinamic acid
Basic information
- CAS
29880-25-9- Standard SMILES
NC(=O)CC(NC(=O)c1ccccc1)C(=O)O- InChIKey
CNRAIJZCOJXFAK-UHFFFAOYSA-N- Molecular formula
- C11H12N2O4
- Average molar mass
- 236.22 g/mol
- Monoisotopic mass
- 236.07970687
Names & identifiers
- Preferred name
- 2-Benzoylamino-succinamic acid
- IUPAC
- 4-amino-2-benzamido-4-oxobutanoic acid
Names & synonyms
2-Benzoylamino-succinamic acid4-amino-2-benzamido-4-oxobutanoic acid3-carbamoyl-2-(phenylformamido)propanoic acid201734-97-6Benzoylasparagine4-Amino-2-benzamido-4-oxo-butanoic acidn2-benzoylasparagineN~2~-(phenylcarbonyl)asparagineNSC23805N~2~-BenzoylasparagineEnamine_005121Oprea1_293306
Show more names
MLS001048900SCHEMBL5280601CHEMBL1990443DTXSID00282006HMS1408I17HMS2267D12BBL010729MFCD00091963
Database identifiers
- CAS
29880-25-9- PubChem CID
- 229813
- DTXSID
DTXSID00282006- ChEMBL
CHEMBL1990443
Properties
Computed structural properties
- XLogP
- -0.3
- Topological polar surface area
- 109 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 311
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Related reactions
1 records
Compound notes
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