Basic information
- CAS
102280-37-5- Standard SMILES
C[NH+](C)[C@H]1CCc2ccccc2[C@H]1OC(=O)c1ccc(N)cc1.[Cl-]- InChIKey
WLRFYCYJZYZANR-CJRXIRLBSA-N- Molecular formula
- C19H23ClN2O2
- Average molar mass
- 346.8 g/mol
- Monoisotopic mass
- 346.1448057
Names & identifiers
- Preferred name
- 1-Naphthol, 1,2,3,4-tetrahydro-2-dimethylamino-, p-aminobenzoate, hydrochloride, (Z)-
- IUPAC
- [(1R,2S)-1-(4-aminobenzoyl)oxy-1,2,3,4-tetrahydronaphthalen-2-yl]-dimethylazanium chloride
Names & synonyms
1-Naphthol, 1,2,3,4-tetrahydro-2-dimethylamino-, p-aminobenzoate, hydrochloride, (Z)-102280-37-5RefChem:1056053trans-1-(p-Aminobenzoyloxy)-2-dimethylamino-1,2,3,4-tetrahydronaphthalene hydrochloridecis-2-Dimethylamino-1,2,3,4-tetrahydro-1-naphthol p-aminobenzoate
Database identifiers
- CAS
102280-37-5- PubChem CID
- 59271
Properties
Computed structural properties
- Topological polar surface area
- 56.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 404
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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