Basic information
- Standard SMILES
O=C(O)CCCC1C(=O)Nc2ccccc21- InChIKey
CDVWMZQPMYOBJM-UHFFFAOYSA-N- Molecular formula
- C12H13NO3
- Average molar mass
- 219.24 g/mol
Names & identifiers
- Preferred name
- 4-(2-oxo-2,3-dihydro-1H-indol-3-yl)butanoic acid
- IUPAC
- 4-(2-oxo-1,3-dihydroindol-3-yl)butanoic acid
Names & synonyms
2971-18-84-(2-oxo-2,3-dihydro-1H-indol-3-yl)butanoic acid4-(2-oxoindolin-3-yl)butanoic acid4-(2-oxo-1,3-dihydroindol-3-yl)butanoic AcidMFCD064116191H-Indole-3-butanoic acid, 2,3-dihydro-2-oxo-7243-03-04-(2,3-Dihydro-2-oxo-1H-indol-3-yl)butanoic acidSCHEMBL8998981DTXSID60993242CDVWMZQPMYOBJM-UHFFFAOYSA-N4-(2-oxoindolin-3-yl)butanoicacid
Show more names
ALBB-006066BBL004558SBB018984STK5004604-(2-oxo-3-indolinyl)butanoic acidAKOS004910757SB64678ST4145816
Database identifiers
- CAS
7243-03-0- PubChem CID
- 2764088
- DTXSID
DTXSID60993242- Nikkaji
- J3.179.459E
Properties
Computed structural properties
- XLogP
- 1
- Topological polar surface area
- 66.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 290
Related reactions
6 records
Linked notes
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