Ethyl 1-(4-chlorophenylsulfonyl)-4-oxo-1,2,3,4-tetrahydropyridine-2-carboxylate

HCID 59342383
Substructure searchFind similar structures

Basic information

Standard SMILES
CCOC(=O)C1CC(=O)C=CN1S(=O)(=O)c1ccc(Cl)cc1
InChIKey
DCDJMVKZPFVUFL-UHFFFAOYSA-N
Molecular formula
C14H14ClNO5S
Average molar mass
343.8 g/mol
Monoisotopic mass
343.0281214

Names & identifiers

Preferred name
Ethyl 1-(4-chlorophenylsulfonyl)-4-oxo-1,2,3,4-tetrahydropyridine-2-carboxylate
IUPAC
ethyl 1-(4-chlorophenyl)sulfonyl-4-oxo-2,3-dihydropyridine-2-carboxylate

Names & synonyms

SCHEMBL3067338DCDJMVKZPFVUFL-UHFFFAOYSA-Nethyl 1-(4-chlorophenylsulfonyl)-4-oxo-1,2,3,4-tetrahydropyridine-2-carboxylate

Database identifiers

PubChem CID
59342383

Properties

Computed structural properties

XLogP
1.6
Topological polar surface area
89.1 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
6
Rotatable bonds
5
Heavy atoms
22

Related reactions

4 records
New reaction record

Linked notes

Loading…