Compound Identification
SMILES
CC[NH+](CC)C(=O)COC1=C2CC3=CC(=CC(CC4=C(OCC(=O)[NH+](CC)CC)C(CC5=C([O-])C(CC1=CC(=C2)C(C)(C)C)=CC(=C5)N=NC1=C(C=C(C=C1)[N+]([O-])=O)[N+]([O-])=O)=CC(=C4)C(C)(C)C)=C3[O-])N=NC1=C(C=C(C=C1)[N+]([O-])=O)[N+]([O-])=O
InChIKey
InChIKey=BFTRHMQDNKTNEZ-UHFFFAOYSA-N
Formula
C60H66N10O14
Mass
1151.244
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Nitrobenzenes
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Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Nitrobenzenes
Intermediate Tree Nodes
Not available
Direct Parent
Nitrobenzenes
Alternative Parents
Phenol ethers Nitroaromatic compounds Phenoxides Alkyl aryl ethers Quaternary ammonium salts Secondary carboxylic acid amides Azo compounds Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Organic zwitterions Organic salts Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic homopolycyclic compounds
Substituents
Nitrobenzene - Nitroaromatic compound - Phenol ether - Alkyl aryl ether - Phenoxide - Quaternary ammonium salt - Azo compound - C-nitro compound - Organic nitro compound - Secondary carboxylic acid amide - Organic oxoazanium - Ether - Carboxylic acid derivative - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organic zwitterion - Carbonyl group - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Organic salt - Aromatic homopolycyclic compound
Description
This compound belongs to the class of organic compounds known as nitrobenzenes. These are compounds containing a nitrobenzene moiety, which consists of a benzene ring with a carbon bearing a nitro group.
External Descriptors
Not available