2-[[(5-Oxo-1-phenylpyrrolidin-3-yl)carbonyl]amino]benzoic acid
Basic information
- CAS
39630-02-9- Standard SMILES
O=C(O)c1ccccc1NC(=O)C1CC(=O)N(c2ccccc2)C1- InChIKey
ARUDIDPMLXPZKC-UHFFFAOYSA-N- Molecular formula
- C18H16N2O4
- Average molar mass
- 324.3 g/mol
- Monoisotopic mass
- 324.111007
Names & identifiers
- Preferred name
- 2-[[(5-Oxo-1-phenylpyrrolidin-3-yl)carbonyl]amino]benzoic acid
- IUPAC
- 2-[(5-oxo-1-phenylpyrrolidine-3-carbonyl)amino]benzoic acid
- English name
- 2-[[(5-Oxo-1-phenylpyrrolidin-3-yl)carbonyl]amino]benzoic acid
- Molecular weight
- 0
Names & synonyms
39630-02-9BRN 0496830o-(2-Oxo-1-phenyl-4-pyrrolidinylcarboxamido)benzoic acid2-[[(5-oxo-1-phenylpyrrolidin-3-yl)carbonyl]amino]benzoic acidBENZOIC ACID, o-(2-OXO-1-PHENYL-4-PYRROLIDINYLCARBOXAMIDO)-DTXSID409602352-{[Hydroxy(5-oxo-1-phenylpyrrolidin-3-yl)methylidene]amino}benzoic acid
Database identifiers
- CAS
39630-02-9- PubChem CID
- 38304
- DTXSID
DTXSID40960235- Nikkaji
- J42.034D
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 86.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 501
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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