Compound Identification
SMILES
[Br-].BrC1=CC2=C(NC(=O)CN=C2C2=CC=CC=N2)C=C1.CC(C)[N+](C)(CCOC(=O)C1C2=CC=CC=C2OC2=CC=CC=C12)C(C)C
InChIKey
InChIKey=VJPXJCQAEYLZCE-UHFFFAOYSA-M
Formula
C37H40Br2N4O4
Mass
764.559
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Benzopyrans
-
Subclass
1-benzopyrans
-
Level 5
Dibenzopyrans
- Level 6 Xanthenes
-
Level 5
Dibenzopyrans
-
Subclass
1-benzopyrans
-
Class
Benzopyrans
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzopyrans
Subclass
1-benzopyrans
Intermediate Tree Nodes
Dibenzopyrans
Direct Parent
Xanthenes
Alternative Parents
1,4-benzodiazepines Diarylethers Alpha amino acids and derivatives Pyridines and derivatives Aryl bromides Benzenoids Tetraalkylammonium salts Heteroaromatic compounds Secondary carboxylic acid amides Carboxylic acid esters Ketimines Lactams Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Oxacyclic compounds Monocarboxylic acids and derivatives Hydrocarbon derivatives Organic oxides Organic zwitterions Carbonyl compounds Organobromides Amines Organic bromide salts
Molecular Framework
Not available
Substituents
Xanthene - Diaryl ether - Benzodiazepine - 1,4-benzodiazepine - Alpha-amino acid or derivatives - Aryl bromide - Aryl halide - Pyridine - Benzenoid - Tetraalkylammonium salt - Heteroaromatic compound - Quaternary ammonium salt - Carboxylic acid ester - Secondary carboxylic acid amide - Ketimine - Lactam - Carboxamide group - Propargyl-type 1,3-dipolar organic compound - Azacycle - Oxacycle - Monocarboxylic acid or derivatives - Ether - Organic 1,3-dipolar compound - Carboxylic acid derivative - Organic nitrogen compound - Organohalogen compound - Organobromide - Imine - Organonitrogen compound - Organooxygen compound - Organic zwitterion - Organic salt - Organic bromide salt - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Amine - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as xanthenes. These are polycyclic aromatic compounds containing a xanthene moiety, which consists of two benzene rings joined to each other by a pyran ring.
External Descriptors
Not available