Basic information
- Standard SMILES
CCOC(=O)c1c(-c2ccccc2)c2cc(Cl)ccc2[nH]c1=O- InChIKey
YNNAVLGZRMNKDA-UHFFFAOYSA-N- Molecular formula
- C18H14ClNO3
- Average molar mass
- 327.8 g/mol
Names & identifiers
- Preferred name
- Ethyl 6-chloro-2-oxo-4-phenyl-1,2-dihydro-3-quinolinecarboxylate
- IUPAC
- ethyl 6-chloro-2-oxo-4-phenyl-1H-quinoline-3-carboxylate
Names & synonyms
93654-27-4ethyl 6-chloro-2-oxo-4-phenyl-1,2-dihydro-3-quinolinecarboxylateethyl 6-chloro-2-oxo-4-phenyl-1H-quinoline-3-carboxylateMFCD00563493ethyl 6-chloro-2-oxo-4-phenyl-1,2-dihydroquinoline-3-carboxylateCHEMBL257323ethyl 6-chloro-2-hydroxy-4-phenylquinoline-3-carboxylateChemDiv3_002388Oprea1_060305Oprea1_182639SCHEMBL4849491YNNAVLGZRMNKDA-UHFFFAOYSA-N
Show more names
HMS1479M12BDBM50371916EBC-00663STK049444STL054189AKOS001270546AKOS001586893SB72184
Database identifiers
- PubChem CID
- 738703
- ChEMBL
CHEMBL257323- Nikkaji
- J2.182.884J
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 55.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 510
Related reactions
6 records
Compound notes
Loading…