Carbanilic acid, m-octyloxy-, 2-(dimethylamino)ethyl ester, hydrochloride
Basic information
- CAS
68097-66-5- Standard SMILES
CCCCCCCCOc1cccc(NC(=O)OCC[NH+](C)C)c1.[Cl-]- InChIKey
LXGMMUMNTVESRN-UHFFFAOYSA-N- Molecular formula
- C19H33ClN2O3
- Average molar mass
- 372.9 g/mol
- Monoisotopic mass
- 372.2179706
Names & identifiers
- Preferred name
- Carbanilic acid, m-octyloxy-, 2-(dimethylamino)ethyl ester, hydrochloride
- IUPAC
- dimethyl-[2-[(3-octoxyphenyl)carbamoyloxy]ethyl]azanium chloride
Names & synonyms
m-Octyloxycarbanilic acid 2-(dimethylamino)ethyl ester hydrochloride68097-66-5CARBANILIC ACID, m-OCTYLOXY-, 2-(DIMETHYLAMINO)ETHYL ESTER, HYDROCHLORIDERefChem:333052
Database identifiers
- CAS
68097-66-5- PubChem CID
- 50072
Properties
Computed structural properties
- Topological polar surface area
- 52 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 13
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 324
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Compound notes
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