Compound Identification
SMILES
CC1=CC2=C(C=C1C)N=C(O2)C1=CC(N\C=C2\C=C(Cl)C=C(C2=O)[N+]([O-])=O)=CC=C1
InChIKey
InChIKey=BOIZSMYJRXZUDI-PTNGSMBKSA-N
Formula
C22H16ClN3O4
Mass
421.84
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Azoles
-
Subclass
Oxazoles
- Level 5 Phenyl-1,3-oxazoles
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Subclass
Oxazoles
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Class
Azoles
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Azoles
Subclass
Oxazoles
Intermediate Tree Nodes
Not available
Direct Parent
Phenyl-1,3-oxazoles
Alternative Parents
Benzoxazoles Aniline and substituted anilines O-quinomethanes Vinylogous amides Heteroaromatic compounds C-nitro compounds Organic oxoazanium compounds Oxacyclic compounds Enamines Chloroalkenes Allylamines Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Vinyl chlorides Organic salts Organic oxides Organochlorides Hydrocarbon derivatives Organic zwitterions
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Phenyl-1,3-oxazole - Benzoxazole - O-quinomethane - Quinomethane - Aniline or substituted anilines - Monocyclic benzene moiety - Benzenoid - Heteroaromatic compound - Vinylogous amide - Ketone - C-nitro compound - Cyclic ketone - Organic nitro compound - Oxacycle - Azacycle - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Chloroalkene - Haloalkene - Enamine - Vinyl halide - Vinyl chloride - Allylamine - Organic oxoazanium - Organic oxygen compound - Organonitrogen compound - Organochloride - Organooxygen compound - Organohalogen compound - Organic oxide - Amine - Organic nitrogen compound - Carbonyl group - Organic zwitterion - Hydrocarbon derivative - Organic salt - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as phenyl-1,3-oxazoles. These are aromatic heterocyclic compounds containing a 1,3-oxazole substituted at one or more positions by a phenyl group.
External Descriptors
Not available