Carbamic acid, (2-(heptyloxy)phenyl)-, 2-(4-ethyl-1-piperazinyl)ethyl ester, dihydrochloride
Basic information
- CAS
141312-20-1- Standard SMILES
CCCCCCCOc1ccccc1NC(=O)OCCN1CCN(CC)CC1.Cl.Cl- InChIKey
GIYSFGVWOAYVHP-UHFFFAOYSA-N- Molecular formula
- C22H39Cl2N3O3
- Average molar mass
- 464.5 g/mol
- Monoisotopic mass
- 463.2368475
Names & identifiers
- Preferred name
- Carbamic acid, (2-(heptyloxy)phenyl)-, 2-(4-ethyl-1-piperazinyl)ethyl ester, dihydrochloride
- IUPAC
- 2-(4-ethylpiperazin-1-yl)ethyl N-(2-heptoxyphenyl)carbamate;dihydrochloride
Names & synonyms
Carbamic acid, (2-(heptyloxy)phenyl)-, 2-(4-ethyl-1-piperazinyl)ethyl ester, dihydrochloride2-(4-Ethyl-1-piperazinyl)ethyl (2-(heptyloxy)phenyl)carbamate dihydrochloride141312-20-1DTXSID40161684RefChem:331878DTXCID20841752-(4-Ethylpiperazin-1-yl)ethyl [2-(heptyloxy)phenyl]carbamate--hydrogen chloride (1/2)
Database identifiers
- CAS
141312-20-1- PubChem CID
- 3072264
- DTXSID
DTXSID40161684
Properties
Computed structural properties
- Topological polar surface area
- 54 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 13
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 414
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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