Primary record
C23H29IN2O
- CAS
- 105668-06-2
- PubChem CID
- 131664775
- SMILES
- CCCC[N+]12CC[C@@]34[C@@H]1C[C@@H](/C(=C\C)/C2)C(=C[O-])C3=NC5=CC=CC=C45.I
- Molecular Formula
- C23H29IN2O
- Molecular Weight
- 476.402
- Exact Mass
- 476.1325
- InChI
- InChI=1S/C23H28N2O.HI/c1-3-5-11-25-12-10-23-19-8-6-7-9-20(19)24-22(23)18(15-26)17(13-21(23)25)16(4-2)14-25;/h4,6-9,15,17,21H,3,5,10-14H2,1-2H3;1H/b16-4-;/t17-,21-,23+,25?;/m0./s1
- InChIKey
- PJYLZVWATFEZJZ-GPDPTMKRSA-N
- LogP
- 4.2417
- TPSA
- 35.42
Names and synonyms
- C23H29IN2O
- 105668-06-2