Compound Identification
SMILES
CC(NNC(=O)C1=CC(I)=CC=C1)=C1C=CC(=O)C=C1
InChIKey
InChIKey=SXVXONZAURVOTL-UHFFFAOYSA-N
Formula
C15H13IN2O2
Mass
380.185
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- 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
Halobenzoic acids and derivatives
Direct Parent
3-halobenzoic acids and derivatives
Alternative Parents
P-quinomethanes Benzoyl derivatives Iodobenzenes Aryl iodides Carboxylic acid hydrazides Organopnictogen compounds Organonitrogen compounds Organoiodides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
3-halobenzoic acid or derivatives - Benzoyl - Quinomethane - P-quinomethane - Halobenzene - Iodobenzene - Aryl halide - Aryl iodide - Carboxylic acid hydrazide - Cyclic ketone - Ketone - Carboxylic acid derivative - Organohalogen compound - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Carbonyl group - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Organoiodide - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as 3-halobenzoic acids and derivatives. These are benzoic acids or derivatives carrying a halogen atom at the 3-position of the benzene ring.
External Descriptors
Not available