Compound Identification
SMILES
CC1=CC(C)=C(OCC(=O)CN=CC2=CC3=C(C=CN3)C=C2)C(=C1)C1CCOCC1
InChIKey
InChIKey=BCVTZYRVRVEYJJ-UHFFFAOYSA-N
Formula
C25H28N2O3
Mass
404.51
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Indoles and derivatives
- Subclass Indoles
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Class
Indoles and derivatives
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Indoles and derivatives
Subclass
Indoles
Intermediate Tree Nodes
Not available
Direct Parent
Indoles
Alternative Parents
m-Xylenes Phenoxy compounds Phenol ethers Alkyl aryl ethers Oxanes Pyrroles Heteroaromatic compounds Shiff bases Ketones Propargyl-type 1,3-dipolar organic compounds Oxacyclic compounds Dialkyl ethers Azacyclic compounds Organopnictogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Indole - Phenoxy compound - M-xylene - Xylene - Phenol ether - Alkyl aryl ether - Benzenoid - Oxane - Monocyclic benzene moiety - Heteroaromatic compound - Pyrrole - Shiff base - Ketone - Oxacycle - Azacycle - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Ether - Dialkyl ether - Aldimine - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Imine - Carbonyl group - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as indoles. These are compounds containing an indole moiety, which consists of pyrrole ring fused to benzene to form 2,3-benzopyrrole.
External Descriptors
Not available