Bicyclo(2.2.1)heptan-2-ol, 3-(4-morpholinylmethyl)-1,7,7-trimethyl-, 3,4,5-trimethoxybenzoate(ester), hydrochloride

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Basic information

CAS: 17092-61-4
Standard SMILES: COc1cc(C(=O)OC2C(CN3CCOCC3)C3CCC2(C)C3(C)C)cc(OC)c1OC.Cl
InChIKey: NZJHKYZNFATUKW-UHFFFAOYSA-N
Molecular formula: C25H38ClNO6
Average molar mass: 484 g/mol
Monoisotopic mass: 483.2387656

Names & identifiers

Preferred name: Bicyclo(2.2.1)heptan-2-ol, 3-(4-morpholinylmethyl)-1,7,7-trimethyl-, 3,4,5-trimethoxybenzoate(ester), hydrochloride
IUPAC: [1,7,7-trimethyl-3-(morpholin-4-ylmethyl)-2-bicyclo[2.2.1]heptanyl] 3,4,5-trimethoxybenzoate;hydrochloride

Names & synonyms

2-Bornanol, 3-(morpholinomethyl)-, 3,4,5-trimethoxybenzoate (ester), hydrochloride17092-61-43,4,5-Trimetossibenzoato di 3-morfolinometil-2-bornanolo cloridrato [Italian]Bicyclo(2.2.1)heptan-2-ol, 3-(4-morpholinylmethyl)-1,7,7-trimethyl-, 3,4,5-trimethoxybenzoate(ester), hydrochloride3,4,5-Trimetossibenzoato di 3-morfolinometil-2-bornanolo cloridratoRefChem:329219DTXSID209378641,7,7-Trimethyl-3-[(morpholin-4-yl)methyl]bicyclo[2.2.1]heptan-2-yl 3,4,5-trimethoxybenzoate--hydrogen chloride (1/1)

Database identifiers

CAS: 17092-61-4
PubChem CID: 204891
DTXSID: DTXSID20937864

Properties

Computed structural properties

Topological polar surface area: 66.5 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 7
Rotatable bonds: 8
Heavy atoms: 33
Formal charge: 0
Complexity: 651

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Compound notes

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