Basic information
- CAS
5478-84-2- Standard SMILES
C=CCOC(=O)C1=C(C)NC2=C(C(=O)CCC2)C1c1ccccc1OC(C)C- InChIKey
YLEJOHKQTBYRDW-UHFFFAOYSA-N- Molecular formula
- C23H27NO4
- Average molar mass
- 381.5 g/mol
- Monoisotopic mass
- 381.19400834
Names & identifiers
- Preferred name
- Prop-2-en-1-yl 2-methyl-5-oxo-4-[2-(propan-2-yloxy)phenyl]-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
- IUPAC
- prop-2-enyl 2-methyl-5-oxo-4-(2-propan-2-yloxyphenyl)-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate
Names & synonyms
5478-84-2ST015209prop-2-en-1-yl 2-methyl-5-oxo-4-[2-(propan-2-yloxy)phenyl]-1,4,5,6,7,8-hexahydroquinoline-3-carboxylateallyl 4-(2-isopropoxyphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylateOprea1_465227Oprea1_747743DTXSID30385913Prop-2-en-1-yl 2-methyl-5-oxo-4-{2-[(propan-2-yl)oxy]phenyl}-1,4,5,6,7,8-hexahydroquinoline-3-carboxylateSTK363541AKOS001601953AKOS021987801CCG-105477
Show more names
prop-2-enyl 2-methyl-5-oxo-4-(2-propan-2-yloxyphenyl)-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylateSR-01000420734SR-01000420734-1prop-2-enyl 2-methyl-4-[2-(methylethoxy)phenyl]-5-oxo-1,4,6,7,8-pentahydroquin oline-3-carboxylate
Database identifiers
- CAS
5478-84-2- PubChem CID
- 2848366
- DTXSID
DTXSID30385913
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 64.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 7
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 703
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…