Basic information
- Standard SMILES
CON=CC1=C(Cl)CC2CCC1N2C.O=C(O)C(=O)O- InChIKey
SCZSOBPQABDNKT-UHFFFAOYSA-N- Molecular formula
- C12H17ClN2O5
- Average molar mass
- 304.72 g/mol
Names & identifiers
- Preferred name
- 3-Chloro-2-(methoxyiminomethyl)-8-methyl-8-azabicyclo[3.2.1]oct-2-ene oxalate
- IUPAC
- 1-(3-chloro-8-methyl-8-azabicyclo[3.2.1]oct-2-en-2-yl)-N-methoxymethanimine;oxalic acid
Names & synonyms
SCHEMBL9404536SCZSOBPQABDNKT-UHFFFAOYSA-N3-Chloro-2-(methoxyiminomethyl)-8-methyl-8-azabicyclo[3.2.1]oct-2-ene oxalate
Database identifiers
- PubChem CID
- 73473544
Properties
Computed structural properties
- Topological polar surface area
- 99.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 3
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 359
Related reactions
2 records
Compound notes
Loading…