Compound Identification
SMILES
CC1=CNC2=C1C=C(C=C2)B(O)OC(C)(C)C(C)(C)O
InChIKey
InChIKey=PTEBTOJZZUIQMJ-UHFFFAOYSA-N
Formula
C15H22BNO3
Mass
275.16
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Indoles and derivatives
-
Subclass
Indoles
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Level 5
3-alkylindoles
- Level 6 3-methylindoles
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Level 5
3-alkylindoles
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Subclass
Indoles
-
Class
Indoles and derivatives
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Indoles and derivatives
Subclass
Indoles
Intermediate Tree Nodes
3-alkylindoles
Direct Parent
3-methylindoles
Alternative Parents
Substituted pyrroles Benzenoids Tertiary alcohols Heteroaromatic compounds Boronic acid esters Organic metalloid salts Azacyclic compounds Organonitrogen compounds Organometalloid compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
3-methylindole - Substituted pyrrole - Benzenoid - Boronic acid ester - Pyrrole - Tertiary alcohol - Heteroaromatic compound - Boronic acid derivative - Organic metalloid salt - Azacycle - Organic oxygen compound - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - Organic metalloid moeity - Alcohol - Hydrocarbon derivative - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as 3-methylindoles. These are aromatic heterocyclic compounds that contain an indole moiety substituted at the 3-position with a methyl group.
External Descriptors
Not available