Compound Identification
SMILES
CC1=C(CC(=O)OCC2=NC=CC(CO[N+]([O-])=O)=C2)C2=C(C=CC(F)=C2)\C1=C/C1=CC=C(C=C1)S(C)=O
InChIKey
InChIKey=KFIVHABUTJTTIW-MSXFZWOLSA-N
Formula
C27H23FN2O6S
Mass
522.55
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
- Class Indenes and isoindenes
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Indenes and isoindenes
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Indenes and isoindenes
Alternative Parents
Phenyl sulfoxides Aryl fluorides Pyridines and derivatives Alkyl nitrates Heteroaromatic compounds Sulfoxides Carboxylic acid esters Organic nitric acids and derivatives Organic nitro compounds Azacyclic compounds Monocarboxylic acids and derivatives Sulfinyl compounds Carbonyl compounds Hydrocarbon derivatives Organonitrogen compounds Organic oxides Organic salts Organic zwitterions Organofluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Phenyl sulfoxide - Indene - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Pyridine - Organic nitrate - Heteroaromatic compound - Alkyl nitrate - Organic nitro compound - Carboxylic acid ester - Organic nitric acid or derivatives - Sulfoxide - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Organic 1,3-dipolar compound - Allyl-type 1,3-dipolar organic compound - Sulfinyl compound - Organofluoride - Carbonyl group - Organohalogen compound - Organic oxide - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Organic nitrogen compound - Organic oxygen compound - Organic salt - Organic zwitterion - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as indenes and isoindenes. These are compounds containing an indene moiety(which consists of a cyclopentadiene fused to a benzene ring), or a isoindene moiety (which consists of a cyclopentadiene fused to cyclohexadiene ring).
External Descriptors
Not available