Basic information
- Standard SMILES
C=CCCCCC1CCC(CC)(CC(=O)O)c2[nH]c3c(C)cccc3c21- InChIKey
RUFGXJDVFDLDEC-UHFFFAOYSA-N- Molecular formula
- C23H31NO2
- Average molar mass
- 353.5 g/mol
- Monoisotopic mass
- 353.23547923
Names & identifiers
- Preferred name
- 1-Ethyl-4-(5-hexenyl)-2,3,4,9-tetrahydro-8-methyl-1H-carbazole1acetic Acid
- IUPAC
- 2-(1-ethyl-4-hex-5-enyl-8-methyl-2,3,4,9-tetrahydrocarbazol-1-yl)acetic acid
Names & synonyms
SCHEMBL9758985RUFGXJDVFDLDEC-UHFFFAOYSA-N1-Ethyl-4-(5-hexenyl)-2,3,4,9-tetrahydro-8-methyl-1H-carbazole-1-acetic Acid1-Ethyl-4-(5-hexenyl)-2,3,4,9-tetrahydro-8-methyl-1H-carbazole1acetic Acid
Database identifiers
- PubChem CID
- 20073327
Properties
Computed structural properties
- XLogP
- 6.4
- Topological polar surface area
- 53.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 8
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 504
Related reactions
4 records
Compound notes
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