Basic information
- Standard SMILES
CN(C)C1(c2ccccc2)CCC(OC(=O)Cc2c[nH]c3ccccc23)CC1.Cl- InChIKey
LBTGFTRIFJVQJP-UHFFFAOYSA-N- Molecular formula
- C24H29ClN2O2
- Average molar mass
- 412.9 g/mol
- Monoisotopic mass
- 412.1917559
Names & identifiers
- Preferred name
- (1H-Indol-3-yl)-acetic acid 4-dimethylamino-4-phenyl-cyclohexyl ester hydrochloride
- IUPAC
- [4-(dimethylamino)-4-phenylcyclohexyl] 2-(1H-indol-3-yl)acetate;hydrochloride
Names & synonyms
SCHEMBL5381813LBTGFTRIFJVQJP-UHFFFAOYSA-N(1H-Indol-3-yl)-acetic acid 4-dimethylamino-4-phenyl-cyclohexyl ester hydrochloride
Database identifiers
- PubChem CID
- 69423004
Properties
Computed structural properties
- Topological polar surface area
- 45.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 521
Related reactions
1 records
Compound notes
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