Compound Identification
SMILES
CC1=NC(=O)C2=CC(CN(CC#C)C3=CC(F)=C(C=C3)C(=O)NCC3=CC(=CC=C3)[N+]([O-])=O)=C(C)C=C2N1
InChIKey
InChIKey=QDONLEJFIXLJSK-UHFFFAOYSA-N
Formula
C28H24FN5O4
Mass
513.529
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
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Class
Benzene and substituted derivatives
-
Subclass
Benzoic acids and derivatives
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Level 5
Benzamides
- Level 6 N-benzylbenzamides
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Level 5
Benzamides
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Subclass
Benzoic acids and derivatives
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Benzoic acids and derivatives
Intermediate Tree Nodes
Benzamides
Direct Parent
N-benzylbenzamides
Alternative Parents
2-halobenzoic acids and derivatives Aminobenzamides Quinazolines Nitrobenzenes Aniline and substituted anilines Benzoyl derivatives Dialkylarylamines Nitroaromatic compounds Pyrimidones Aralkylamines Fluorobenzenes Aryl fluorides Heteroaromatic compounds Vinylogous halides Vinylogous amides Secondary carboxylic acid amides Amino acids and derivatives Organic oxoazanium compounds Azacyclic compounds Propargyl-type 1,3-dipolar organic compounds Acetylides Organic zwitterions Hydrocarbon derivatives Organofluorides Organooxygen compounds Organopnictogen compounds Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
N-benzylbenzamide - Diazanaphthalene - Aminobenzamide - Halobenzoic acid or derivatives - Aminobenzoic acid or derivatives - 2-halobenzoic acid or derivatives - Quinazoline - Nitrobenzene - Nitroaromatic compound - Tertiary aliphatic/aromatic amine - Benzoyl - Dialkylarylamine - Aniline or substituted anilines - Aralkylamine - Pyrimidone - Fluorobenzene - Halobenzene - Pyrimidine - Aryl fluoride - Aryl halide - Vinylogous amide - Vinylogous halide - Heteroaromatic compound - Amino acid or derivatives - Carboxamide group - C-nitro compound - Organic nitro compound - Secondary carboxylic acid amide - Tertiary amine - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Acetylide - Carboxylic acid derivative - Azacycle - Organic oxoazanium - Organoheterocyclic compound - Organic zwitterion - Hydrocarbon derivative - Organopnictogen compound - Amine - Organic nitrogen compound - Organic oxygen compound - Organohalogen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Organic oxide - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as n-benzylbenzamides. These are compounds containing a benzamide moiety that is N-linked to a benzyl group.
External Descriptors
Not available