Basic information
- CAS
34703-80-5- Standard SMILES
O=C([O-])C(=O)[O-].c1ccc(C[NH2+]CCOC[n+]2c[nH]c3ccccc32)cc1- InChIKey
XXAWIEZOAZFYOI-UHFFFAOYSA-N- Molecular formula
- C19H21N3O5
- Average molar mass
- 371.4 g/mol
- Monoisotopic mass
- 371.14812078
Names & identifiers
- Preferred name
- Benzimidazole, 1-((2-(benzylamino)ethoxy)methyl)-, oxalate
- IUPAC
- 2-(3H-benzimidazol-1-ium-1-ylmethoxy)ethyl-benzylazanium;oxalate
Names & synonyms
1-((2-(Benzylamino)ethoxy)methyl)-benzimidazole oxalate34703-80-5BENZIMIDAZOLE, 1-((2-(BENZYLAMINO)ETHOXY)METHYL)-, OXALATERefChem:325780
Database identifiers
- CAS
34703-80-5- PubChem CID
- 36890
Properties
Computed structural properties
- Topological polar surface area
- 126 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 7
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 354
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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