Carbanilic acid, o-heptyloxy-, 2-(dimethylamino)ethyl ester, hydrochloride
Basic information
- CAS
68097-62-1- Standard SMILES
CCCCCCCOc1ccccc1NC(=O)OCC[NH+](C)C.[Cl-]- InChIKey
YXBSSKIKVXKAEY-UHFFFAOYSA-N- Molecular formula
- C18H31ClN2O3
- Average molar mass
- 358.9 g/mol
- Monoisotopic mass
- 358.2023205
Names & identifiers
- Preferred name
- Carbanilic acid, o-heptyloxy-, 2-(dimethylamino)ethyl ester, hydrochloride
- IUPAC
- 2-[(2-heptoxyphenyl)carbamoyloxy]ethyl-dimethylazanium chloride
Names & synonyms
2-(Dimethylamino)ethyl o-(heptyloxy)carbanilate hydrochloride68097-62-1o-Heptyloxycarbanilic acid 2-(dimethylamino)ethyl ester hydrochlorideCARBANILIC ACID, o-HEPTYLOXY-, 2-(DIMETHYLAMINO)ETHYL ESTER, HYDROCHLORIDERefChem:333131
Database identifiers
- CAS
68097-62-1- PubChem CID
- 50064
Properties
Computed structural properties
- Topological polar surface area
- 52 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 12
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 311
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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