5,7-Dichloro-4-(3,4-dimethoxyphenyl)-3-methyl-1,2,3,4-tetrahydroquinoline-2-carboxylic acid ethyl ester

HCID 10180682
NotesReactions
Substructure searchFind similar structures

Basic information

Standard SMILES
CCOC(=O)C1Nc2cc(Cl)cc(Cl)c2C(c2ccc(OC)c(OC)c2)C1C
InChIKey
OJNQIOITKONUTD-UHFFFAOYSA-N
Molecular formula
C21H23Cl2NO4
Average molar mass
424.3 g/mol

Names & identifiers

Preferred name
5,7-Dichloro-4-(3,4-dimethoxyphenyl)-3-methyl-1,2,3,4-tetrahydroquinoline-2-carboxylic acid ethyl ester
IUPAC
ethyl 5,7-dichloro-4-(3,4-dimethoxyphenyl)-3-methyl-1,2,3,4-tetrahydroquinoline-2-carboxylate

Names & synonyms

SCHEMBL6765883OJNQIOITKONUTD-UHFFFAOYSA-N5,7-dichloro-4-(3,4-dimethoxyphenyl)-3-methyl-1,2,3,4-tetrahydroquinoline-2-carboxylic acid ethyl ester

Database identifiers

PubChem CID
10180682

Properties

Computed structural properties

XLogP
5.7
Topological polar surface area
56.8 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
5
Rotatable bonds
6
Heavy atoms
28

Related reactions

1 records
New reaction record

Compound notes

Loading…