CHEBI:124458 - 2-chloro-3-(4-methylanilino)naphthalene-1,4-dione

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 2-chloro-3-(4-methylanilino)naphthalene-1,4-dione
ChEBI ID CHEBI:124458
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
more structures >>
Formulae C17H12ClNO2
C17H12ClNO2
Net Charge 0
Average Mass 297.736
Monoisotopic Mass 297.05566
InChI InChI=1S/C17H12ClNO2/c1-10-6-8-11(9-7-10)19-15-14(18)16(20)12-4-2-3-5-13(12)17(15)21/h2-9,19H,1H3
InChIKey RFTKKJMESXPXLC-UHFFFAOYSA-N
SMILES CC1=CC=C(C=C1)NC2=C(C(=O)C3=CC=CC=C3C2=O)Cl
ChEBI Ontology
Outgoing 2-chloro-3-(4-methylanilino)naphthalene-1,4-dione (CHEBI:124458) is a 1,4-naphthoquinones (CHEBI:132142)
Manual Xref Database
LSM-35900 LINCS
View more database links
Last Modified
07 June 2016