Compound Identification
SMILES
CCC1=CC2=C(OC(=N2)C2=CC(N\C=C3/C=C(Cl)C=C(C3=O)[N+]([O-])=O)=CC=C2)C=C1
InChIKey
InChIKey=NFDPYYBALCFZJO-NTCAYCPXSA-N
Formula
C22H16ClN3O4
Mass
421.84
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
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Class
Azoles
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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 Vinyl chlorides Secondary amines Propargyl-type 1,3-dipolar organic compounds Oxacyclic compounds Allylamines Azacyclic compounds Organic oxoazanium compounds Chloroalkenes Enamines Hydrocarbon derivatives Organic oxides Organic salts Organic zwitterions Organochlorides Organopnictogen compounds Aldehydes
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Phenyl-1,3-oxazole - Benzoxazole - Quinomethane - O-quinomethane - Aniline or substituted anilines - Monocyclic benzene moiety - Benzenoid - Vinylogous amide - Heteroaromatic compound - Cyclic ketone - Ketone - C-nitro compound - Organic nitro compound - Haloalkene - Vinyl chloride - Allylamine - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Secondary amine - Organic oxoazanium - Enamine - Chloroalkene - Oxacycle - Vinyl halide - Azacycle - Aldehyde - Organooxygen compound - Organonitrogen compound - Organochloride - Organic zwitterion - Organohalogen compound - Organic salt - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Carbonyl group - Organic oxygen compound - Organic nitrogen compound - Amine - 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