Basic information
- CAS
6525-13-9- Standard SMILES
CC(C)C(CCC[NH+]1CCCCC1)(C(=O)O)c1cccc2ccccc12.[Cl-]- InChIKey
MVOZKCGANZDCNJ-UHFFFAOYSA-N- Molecular formula
- C23H32ClNO2
- Average molar mass
- 390 g/mol
- Monoisotopic mass
- 389.212157
Names & identifiers
- Preferred name
- 1-Naphthaleneacetic acid, alpha-isopropyl-alpha-(3-piperidinopropyl)-, hydrochloride
- IUPAC
- 2-naphthalen-1-yl-5-piperidin-1-ium-1-yl-2-propan-2-ylpentanoic acid chloride
Names & synonyms
1-Naphthaleneacetic acid, alpha-isopropyl-alpha-(3-piperidinopropyl)-, hydrochloride6525-13-9RefChem:1055951alpha-Isopropyl-alpha-(3-piperidinopropyl)-1-naphthaleneacetic acid hydrochloride
Database identifiers
- CAS
6525-13-9- PubChem CID
- 23022
Properties
Computed structural properties
- Topological polar surface area
- 41.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 7
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 457
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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