Basic information
- Standard SMILES
CCON=Cc1ccc(C(=O)OCC)cc1.Cl- InChIKey
SZKVUWCICXUCOI-UHFFFAOYSA-N- Molecular formula
- C12H16ClNO3
- Average molar mass
- 257.71 g/mol
- Monoisotopic mass
- 257.0818711
Names & identifiers
- Preferred name
- Ethyl 4-[1-(ethoxy)iminomethyl]benzoate hydrochloride
- IUPAC
- ethyl 4-(ethoxyiminomethyl)benzoate;hydrochloride
Names & synonyms
SCHEMBL5548174SZKVUWCICXUCOI-UHFFFAOYSA-Nethyl 4-[1-(ethoxy)iminomethyl]benzoate hydrochloride
Database identifiers
- PubChem CID
- 73992977
Properties
Computed structural properties
- Topological polar surface area
- 47.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 232
Related reactions
1 records
Compound notes
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