Compound Identification
SMILES
CCCCN1C2=CC=CC=C2C(C)(C)\C1=C\C1=C([O-])C(C1=O)=C1C=CC(C=C1)=C1C=CC(C=C1)=C1C(=O)C(=CC2=[N+](CCCC)C3=CC=CC=C3C2(C)C)C1=O
InChIKey
InChIKey=MHVRZBBLUKJVAO-VPSBLXEASA-N
Formula
C50H48N2O4
Mass
740.944
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Indoles and derivatives
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Subclass
Indoles
- Level 5 3-alkylindoles
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Subclass
Indoles
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Class
Indoles and derivatives
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Indoles and derivatives
Subclass
Indoles
Intermediate Tree Nodes
Not available
Direct Parent
3-alkylindoles
Alternative Parents
Tertiary alkylarylamines P-quinodimethanes Benzene and substituted derivatives Vinylogous acids Cyclic ketones Propargyl-type 1,3-dipolar organic compounds Enamines Azacyclic compounds Organic salts Organic oxides Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
3-alkylindole - P-quinodimethane - Tertiary aliphatic/aromatic amine - Monocyclic benzene moiety - Benzenoid - Vinylogous acid - Ketone - Tertiary amine - Cyclic ketone - Azacycle - Enamine - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Amine - Carbonyl group - Organic salt - Organic cation - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as 3-alkylindoles. These are compounds containing an indole moiety that carries an alkyl chain at the 3-position.
External Descriptors
Not available