Basic information
- CAS
37391-17-6- Standard SMILES
C[NH+](C)CCCN1C(=O)C(C)(c2ccccc2)c2ccccc21.O=C([O-])C(=O)O- InChIKey
NSEDLDYHLBZXPR-UHFFFAOYSA-N- Molecular formula
- C22H26N2O5
- Average molar mass
- 398.5 g/mol
- Monoisotopic mass
- 398.18417193
Names & identifiers
- Preferred name
- 2H-Indol-2-one, 1,3-dihydro-1-(3-(dimethylamino)propyl)-3-methyl-3-phenyl-, oxalate (1:1)
- IUPAC
- dimethyl-[3-(3-methyl-2-oxo-3-phenylindol-1-yl)propyl]azanium;2-hydroxy-2-oxoacetate
Names & synonyms
37391-17-61,3-Dihydro-1-(3-(dimethylamino)propyl)-3-methyl-3-phenyl-2H-indol-2-one oxalate2H-Indol-2-one, 1,3-dihydro-1-(3-(dimethylamino)propyl)-3-methyl-3-phenyl-, oxalate (1:1)RefChem:268693
Database identifiers
- CAS
37391-17-6- PubChem CID
- 37726
Properties
Computed structural properties
- Topological polar surface area
- 102 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 494
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…