Services
Research
Training
Industry
About us
ChEBI
Examples:
iron*
,
InChI=1S/CH4O/c1-2/h2H,1H3
,
caffeine
Advanced
Home
Advanced Search
Browse
Documentation
Download
Tools
About ChEBI
Submit
Contact us
DiNA
Statistics
Entity of the Month
Periodic Table
Ontology
Train online
User Manual
Annotation Manual
Developer Manual
FAQ's
BiNChE
libChEBI
Web Services
ChEBI
> Main
CHEBI:48488 - 6-(benzyloxy)-2-chloroquinoline
Main
ChEBI Ontology
Automatic Xrefs
Reactions
Pathways
Models
ChEBI Name
6-(benzyloxy)-2-chloroquinoline
ChEBI ID
CHEBI:48488
Stars
This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download
Molfile
XML
SDF
Find compounds which contain this structure
Find compounds which resemble this structure
Take structure to the Advanced Search
Formula
C16H12ClNO
Net Charge
0
Average Mass
269.72532
Monoisotopic Mass
269.06074
InChI
InChI=1S/C16H12ClNO/c17-16-9-6-13-10-14(7-8-15(13)18-16)19-11-12-4-2-1-3-5-12/h1-10H,11H2
InChIKey
CYCJPIBUDBOUQD-UHFFFAOYSA-N
SMILES
Clc1ccc2cc(OCc3ccccc3)ccc2n1
ChEBI Ontology
Outgoing
6-(benzyloxy)-2-chloroquinoline (
CHEBI:48488
)
has part
benzyloxy group (
CHEBI:48508
)
6-(benzyloxy)-2-chloroquinoline (
CHEBI:48488
)
is a
organochlorine compound (
CHEBI:36683
)
6-(benzyloxy)-2-chloroquinoline (
CHEBI:48488
)
is a
quinolines (
CHEBI:26513
)
IUPAC Name
6-(benzyloxy)-2-chloroquinoline
Manual Xref
Database
EP1870402
Patent
View more database links
Last Modified
17 April 2008