Basic information
- CAS
58982-14-2- Standard SMILES
CCC1C=CC=Cc2[nH]c3c(c21)C(C)(CC[NH+](C)C)CCC3.[Cl-]- InChIKey
UXRRCIYCYHKPIU-UHFFFAOYSA-N- Molecular formula
- C20H31ClN2
- Average molar mass
- 334.9 g/mol
- Monoisotopic mass
- 334.2175767
Names & identifiers
- Preferred name
- Cyclohept(b)indole-1-ethylamine, 1,2,3,4,5,10-hexahydro-10-ethyl-N,N,1-trimethyl-, hydrochloride
- IUPAC
- 2-(10-ethyl-1-methyl-3,4,5,10-tetrahydro-2H-cyclohepta[b]indol-1-yl)ethyl-dimethylazanium chloride
Names & synonyms
10-Ethyl-N,N,1-trimethyl-1,2,3,4,5,10-hexahydrocyclohept(b)indole-1-ethanamine hydrochlorideCyclohept(b)indole-1-ethylamine, 1,2,3,4,5,10-hexahydro-10-ethyl-N,N,1-trimethyl-, hydrochloride58982-14-2RefChem:335033
Database identifiers
- CAS
58982-14-2- PubChem CID
- 42918
Properties
Computed structural properties
- Topological polar surface area
- 20.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 4
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 439
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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